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

Systemtic Name: ethyl 2-methyl-4-(3-nitro-4-oxidanyl-phenyl)-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CCCC(=O)C2C1C3=CC(=C(C=C3)O)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CCCC(=O)C2C1C3=CC(=C(C=C3)O)[N+](=O)[O-])C

InChI

InChI=1S/C19H20N2O6/c1-3-27-19(24)16-10(2)20-12-5-4-6-15(23)18(12)17(16)11-7-8-14(22)13(9-11)21(25)26/h5,7-9,17-18,20,22H,3-4,6H2,1-2H3