ethyl (3S)-1-(1-ethanoylpiperidin-4-yl)-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-(1-ethanoylpiperidin-4-yl)-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(1-acetyl-4-piperidyl)-3-benzyl-piperidine-3-carboxylate CAS Name: (3S)-1-(1-acetyl-4-piperidinyl)-3-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(1-acetylpiperidin-4-yl)-3-benzylpiperidine-3-carboxylate Traditional Name: (3S)-1-(1-acetyl-4-piperidyl)-3-benzyl-nipecotic acid ethyl ester Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C2CCN(CC2)C(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C2CCN(CC2)C(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H32N2O3/c1-3-27-21(26)22(16-19-8-5-4-6-9-19)12-7-13-24(17-22)20-10-14-23(15-11-20)18(2)25/h4-6,8-9,20H,3,7,10-17H2,1-2H3/t22-/m0/s1