ethyl 1-[3-[(2-methylphenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(2-methylphenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[o-tolylcarbamoyl(phenethyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-[[(2-methylanilino)-oxomethyl]-phenethylamino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(2-methylphenyl)carbamoyl-phenethylamino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[o-tolylcarbamoyl(phenethyl)amino]propanoyl]nipecotic acid ethyl ester Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCN(CCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCN(CCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C27H35N3O4/c1-3-34-26(32)23-13-9-17-30(20-23)25(31)16-19-29(18-15-22-11-5-4-6-12-22)27(33)28-24-14-8-7-10-21(24)2/h4-8,10-12,14,23H,3,9,13,15-20H2,1-2H3,(H,28,33)