ethyl 1-[2-[3-[cyclopentylcarbonyl-(phenylmethyl)amino]phenyl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[3-[cyclopentylcarbonyl-(phenylmethyl)amino]phenyl]ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[3-[benzyl(cyclopentanecarbonyl)amino]phenyl]acetyl]piperidine-3-carboxylate CAS Name: 1-[2-[3-[[cyclopentyl(oxo)methyl]-(phenylmethyl)amino]phenyl]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-[benzyl(cyclopentanecarbonyl)amino]phenyl]acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-[3-[benzyl(cyclopentanecarbonyl)amino]phenyl]acetyl]nipecotic acid ethyl ester Formula: C29H36N2O4 MolecularWeight: 476.60714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CCCC4

InChI

InChI=1S/C29H36N2O4/c1-2-35-29(34)25-15-9-17-30(21-25)27(32)19-23-12-8-16-26(18-23)31(20-22-10-4-3-5-11-22)28(33)24-13-6-7-14-24/h3-5,8,10-12,16,18,24-25H,2,6-7,9,13-15,17,19-21H2,1H3