ethyl 1-[(3S)-1-(cyclohexylmethyl)-6-oxidanylidene-piperidin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3S)-1-(cyclohexylmethyl)-6-oxidanylidene-piperidin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[(3S)-1-(cyclohexylmethyl)-6-oxo-piperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[(3S)-1-(cyclohexylmethyl)-6-oxo-3-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3S)-1-(cyclohexylmethyl)-6-oxopiperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(3S)-1-(cyclohexylmethyl)-6-keto-nipecotoyl]isonipecotic acid ethyl ester Formula: C21H34N2O4 MolecularWeight: 378.50566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCC(=O)N(C2)CC3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)[C@H]2CCC(=O)N(C2)CC3CCCCC3

InChI

InChI=1S/C21H34N2O4/c1-2-27-21(26)17-10-12-22(13-11-17)20(25)18-8-9-19(24)23(15-18)14-16-6-4-3-5-7-16/h16-18H,2-15H2,1H3/t18-/m0/s1