methyl 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3,5-dimethylanilino)-2-oxoethyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3,5-dimethylanilino)-2-keto-ethyl]isonipecotic acid methyl ester Formula: C17H24N2O3 MolecularWeight: 304.38406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)OC)C

InChI

InChI=1S/C17H24N2O3/c1-12-8-13(2)10-15(9-12)18-16(20)11-19-6-4-14(5-7-19)17(21)22-3/h8-10,14H,4-7,11H2,1-3H3,(H,18,20)