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

Systemtic Name: methyl 4-[4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexen-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(benzylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butanoate CAS Name: 4-[4,4-dimethyl-6-oxo-2-[(phenylmethyl)amino]-1-cyclohexenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(benzylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutanoate Traditional Name: 4-[2-(benzylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-4-keto-butyric acid methyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCC(=O)OC)NCC2=CC=CC=C2)C

InChI

InChI=1S/C20H25NO4/c1-20(2)11-15(21-13-14-7-5-4-6-8-14)19(17(23)12-20)16(22)9-10-18(24)25-3/h4-8,21H,9-13H2,1-3H3