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

Systemtic Name: methyl 4-[2-(hexylamino)-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(hexylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butanoate CAS Name: 4-[2-(hexylamino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(hexylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutanoate Traditional Name: 4-[2-(hexylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-4-keto-butyric acid methyl ester Formula: C19H31NO4 MolecularWeight: 337.45374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)OC

Isomeric SMILES

CCCCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)OC

InChI

InChI=1S/C19H31NO4/c1-5-6-7-8-11-20-14-12-19(2,3)13-16(22)18(14)15(21)9-10-17(23)24-4/h20H,5-13H2,1-4H3