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

Systemtic Name: methyl 4-[2-[(4-bromophenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butanoate CAS Name: 4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(4-bromoanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutanoate Traditional Name: 4-[2-(4-bromoanilino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-4-keto-butyric acid methyl ester Formula: C19H22BrNO4 MolecularWeight: 408.28628

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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)Br)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C19H22BrNO4/c1-19(2)10-14(21-13-6-4-12(20)5-7-13)18(16(23)11-19)15(22)8-9-17(24)25-3/h4-7,21H,8-11H2,1-3H3