ethyl 1-[(4-acetamidophenyl)methyl]-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-[(4-acetamidophenyl)methyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-(4-acetamidobenzyl)-4-phenethyl-isonipecotic acid ethyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC=C(C=C2)NC(=O)C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC=C(C=C2)NC(=O)C)CCC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c1-3-30-24(29)25(14-13-21-7-5-4-6-8-21)15-17-27(18-16-25)19-22-9-11-23(12-10-22)26-20(2)28/h4-12H,3,13-19H2,1-2H3,(H,26,28)