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 6 results

Search term: AJTBWVSZFCBVQL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2153353

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)
C15H19N5269.34486261600
5254158

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)/t12-/m0/s1
C15H19N5269.344862100
7839019

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)/t12-/m1/s1
C15H19N5269.34492100
2506222

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)/p+1
C15H20N5270.35231100
4892786

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)/p+1/t12-/m0/s1
C15H20N5270.35231100
4892787

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C15H19N5/c1-10-9-11(2)18-15(17-10)20-14(16)19-12(3)13-7-5-4-6-8-13/h4-9,12H,1-3H3,(H3,16,17,18,19,20)/p+1/t12-/m1/s1
C15H20N5270.35231100

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