ethyl 1-[3-[(4-chlorophenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[(4-chlorophenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(4-chlorophenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-[[(4-chloroanilino)-oxomethyl]-phenethylamino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-chlorophenyl)carbamoyl-phenethylamino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[(4-chlorophenyl)carbamoyl-phenethyl-amino]propanoyl]nipecotic acid ethyl ester Formula: C26H32ClN3O4 MolecularWeight: 486.00298

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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=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCN(CCC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H32ClN3O4/c1-2-34-25(32)21-9-6-16-30(19-21)24(31)15-18-29(17-14-20-7-4-3-5-8-20)26(33)28-23-12-10-22(27)11-13-23/h3-5,7-8,10-13,21H,2,6,9,14-19H2,1H3,(H,28,33)