Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 8 results

Search term: LKWCVKAHHUJPQO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5005362

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1+/t7-,8+,9+/m0/s1
C11H14BrN2O8P413.1152161700
26330286

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1+/t7-,8+,9-/m1/s1
C11H14BrN2O8P413.11524400
4944044

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1-/t7-,8+,9+/m0/s1
C11H14BrN2O8P413.11523300
2737132

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)
C11H14BrN2O8P413.1152212100
22252507

Double-bond stereo

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1+
C11H14BrN2O8P413.11522100
57492038

Double-bond stereo

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1+/t7?,8-,9-/m0/s1
C11H14BrN2O8P413.11521100
71360807

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/b2-1+/t7-,8+,9+/m1/s1
C11H14BrN2O8P413.11521100
19003702

Charge

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C11H14BrN2O8P/c12-2-1-6-4-14(11(17)13-10(6)16)9-3-7(15)8(22-9)5-21-23(18,19)20/h1-2,4,7-9,15H,3,5H2,(H,13,16,17)(H2,18,19,20)/p-2/b2-1+/t7-,8+,9+/m0/s1
C11H12BrN2O8P411.10041100

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