methyl 5-[3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[3-(3,4-dimethylanilino)-1-piperidyl]-5-oxo-pentanoate CAS Name: 5-[3-(3,4-dimethylanilino)-1-piperidinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[3-(3,4-dimethylanilino)piperidin-1-yl]-5-oxopentanoate Traditional Name: 5-[3-(3,4-dimethylanilino)piperidino]-5-keto-valeric acid methyl ester Formula: C19H28N2O3 MolecularWeight: 332.43722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)CCCC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)CCCC(=O)OC)C

InChI

InChI=1S/C19H28N2O3/c1-14-9-10-16(12-15(14)2)20-17-6-5-11-21(13-17)18(22)7-4-8-19(23)24-3/h9-10,12,17,20H,4-8,11,13H2,1-3H3