methyl (4aR,8aS)-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-2-oxidanylidene-8,8a-dihydro-5H-quinoline-4a-carboxylate

Systemtic Name: methyl (4aR,8aS)-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-2-oxidanylidene-8,8a-dihydro-5H-quinoline-4a-carboxylate Openeye Name: methyl (4aR,8aS)-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-2-oxo-8,8a-dihydro-5H-quinoline-4a-carboxylate CAS Name: (4aR,8aS)-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-2-oxo-8,8a-dihydro-5H-quinoline-4a-carboxylic acid methyl ester IUPAC Name: methyl (4aR,8aS)-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-2-oxo-8,8a-dihydro-5H-quinoline-4a-carboxylate Traditional Name: (4aR,8aS)-2-keto-6,7-dimethyl-1-(2-nitrophenyl)sulfonyl-8,8a-dihydro-5H-quinoline-4a-carboxylic acid methyl ester Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2(C=CC(=O)N(C2C1)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC1=C(C[C@]2(C=CC(=O)N([C@H]2C1)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C19H20N2O7S/c1-12-10-16-19(11-13(12)2,18(23)28-3)9-8-17(22)20(16)29(26,27)15-7-5-4-6-14(15)21(24)25/h4-9,16H,10-11H2,1-3H3/t16-,19-/m0/s1