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

Systemtic Name: ethyl 1-[3-[(4-methoxyphenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[(4-methoxyphenyl)carbamoyl-phenethyl-amino]propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-[[(4-methoxyanilino)-oxomethyl]-phenethylamino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-methoxyphenyl)carbamoyl-phenethylamino]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[(4-methoxyphenyl)carbamoyl-phenethyl-amino]propanoyl]nipecotic acid ethyl ester Formula: C27H35N3O5 MolecularWeight: 481.5839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35N3O5/c1-3-35-26(32)22-10-7-17-30(20-22)25(31)16-19-29(18-15-21-8-5-4-6-9-21)27(33)28-23-11-13-24(34-2)14-12-23/h4-6,8-9,11-14,22H,3,7,10,15-20H2,1-2H3,(H,28,33)