propan-2-yl 2-methyl-4-(3-nitro-4-oxidanyl-phenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: propan-2-yl 2-methyl-4-(3-nitro-4-oxidanyl-phenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: isopropyl 4-(4-hydroxy-3-nitro-phenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(4-hydroxy-3-nitro-phenyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid isopropyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CCC=C2N1)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C2C(=O)CCC=C2N1)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C20H22N2O6/c1-10(2)28-20(25)17-11(3)21-13-5-4-6-16(24)19(13)18(17)12-7-8-15(23)14(9-12)22(26)27/h5,7-10,18-19,21,23H,4,6H2,1-3H3