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: BZCOJKQCVCRIOF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2352641

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)
C17H17NO4299.32118241300
5044073

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/t11?,12?,14-,15+/m1/s1
C17H17NO4299.32122100
10046068

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/t11-,12+,14-,15+/m1/s1
C17H17NO4299.32122100
10046070

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/t11-,12+,14+,15+/m1/s1
C17H17NO4299.32122100
10046069

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/p-1/t11-,12-,14-,15-/m0/s1
C17H16NO4298.31381100
10046067

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/p-1/t11-,12-,14+,15-/m0/s1
C17H16NO4298.31381100
2509592

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C17H17NO4/c1-9(19)10-4-6-13(7-5-10)18-16(20)14-11-2-3-12(8-11)15(14)17(21)22/h2-7,11-12,14-15H,8H2,1H3,(H,18,20)(H,21,22)/p-1
C17H16NO4298.31381100

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