ethyl 1-[2-[3-[cyclopropylcarbonyl-(phenylmethyl)amino]phenyl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[3-[cyclopropylcarbonyl-(phenylmethyl)amino]phenyl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[3-[benzyl(cyclopropanecarbonyl)amino]phenyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[3-[[cyclopropyl(oxo)methyl]-(phenylmethyl)amino]phenyl]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[3-[benzyl(cyclopropanecarbonyl)amino]phenyl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[3-[benzyl(cyclopropanecarbonyl)amino]phenyl]acetyl]isonipecotic acid ethyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CC4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CC2=CC(=CC=C2)N(CC3=CC=CC=C3)C(=O)C4CC4

InChI

InChI=1S/C27H32N2O4/c1-2-33-27(32)23-13-15-28(16-14-23)25(30)18-21-9-6-10-24(17-21)29(26(31)22-11-12-22)19-20-7-4-3-5-8-20/h3-10,17,22-23H,2,11-16,18-19H2,1H3