methyl 4-[4,4-dimethyl-2-[(4-nitrophenyl)amino]-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4,4-dimethyl-2-[(4-nitrophenyl)amino]-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4,4-dimethyl-2-(4-nitroanilino)-6-oxo-cyclohexen-1-yl]-4-oxo-butanoate CAS Name: 4-[4,4-dimethyl-2-(4-nitroanilino)-6-oxo-1-cyclohexenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4,4-dimethyl-2-(4-nitroanilino)-6-oxocyclohexen-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[6-keto-4,4-dimethyl-2-(4-nitroanilino)cyclohexen-1-yl]butyric acid methyl ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H22N2O6/c1-19(2)10-14(20-12-4-6-13(7-5-12)21(25)26)18(16(23)11-19)15(22)8-9-17(24)27-3/h4-7,20H,8-11H2,1-3H3