ethyl 1-[(5-ethanoyl-2,4-dimethyl-1H-pyrrol-3-yl)carbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(5-ethanoyl-2,4-dimethyl-1H-pyrrol-3-yl)carbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(5-acetyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[(5-acetyl-2,4-dimethyl-1H-pyrrol-3-yl)-oxomethyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-acetyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-(5-acetyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C26H34N2O4 MolecularWeight: 438.55916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(NC(=C2C)C(=O)C)C)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(NC(=C2C)C(=O)C)C)CCCC3=CC=CC=C3

InChI

InChI=1S/C26H34N2O4/c1-5-32-25(31)26(13-9-12-21-10-7-6-8-11-21)14-16-28(17-15-26)24(30)22-18(2)23(20(4)29)27-19(22)3/h6-8,10-11,27H,5,9,12-17H2,1-4H3