methyl 3,6,6-trimethyl-4-(2-nitrophenyl)-8-oxidanylidene-1,4,5,7-tetrahydroquinoline-2-carboxylate

Systemtic Name: methyl 3,6,6-trimethyl-4-(2-nitrophenyl)-8-oxidanylidene-1,4,5,7-tetrahydroquinoline-2-carboxylate Openeye Name: methyl 3,6,6-trimethyl-4-(2-nitrophenyl)-8-oxo-1,4,5,7-tetrahydroquinoline-2-carboxylate CAS Name: 3,6,6-trimethyl-4-(2-nitrophenyl)-8-oxo-1,4,5,7-tetrahydroquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 3,6,6-trimethyl-4-(2-nitrophenyl)-8-oxo-1,4,5,7-tetrahydroquinoline-2-carboxylate Traditional Name: 8-keto-3,6,6-trimethyl-4-(2-nitrophenyl)-1,4,5,7-tetrahydroquinoline-2-carboxylic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(C1C3=CC=CC=C3[N+](=O)[O-])CC(CC2=O)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(NC2=C(C1C3=CC=CC=C3[N+](=O)[O-])CC(CC2=O)(C)C)C(=O)OC

InChI

InChI=1S/C20H22N2O5/c1-11-16(12-7-5-6-8-14(12)22(25)26)13-9-20(2,3)10-15(23)18(13)21-17(11)19(24)27-4/h5-8,16,21H,9-10H2,1-4H3