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 9 results

Search term: PRGQOPPDPVELEG (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
75667

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)
C15H14N2O3270.2833315700
102714

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m0/s1
C15H14N2O3270.2833274500
19978508

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m1/s1
C15H14N2O3270.2833121700
48060909

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14+
C15H14N2O3270.2833121500
23976975

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14?/m0/s1
C15H14N2O3270.28332100
95740633

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/i18D,19D/hD2
C15H10D4N2O3274.30791100
110404679

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/i1D,3D,5D,7D
C15H10D4N2O3274.30791100
110404709

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/i1D,2D,3D,4D,5D,6D,7D,8D,13D,14D
C15H4D10N2O3280.34491100
128918750

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m0/s1/i1D,3D,5D,7D
C15H10D4N2O3274.30791100

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