(phenylmethyl) 4-[4-(4-ethylphenyl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-(4-ethylphenyl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: benzyl 4-[4-(4-ethylphenyl)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-(4-ethylphenyl)phenyl]-oxomethyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(4-ethylphenyl)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-ethylphenyl)benzoyl]piperazine-1-carboxylic acid benzyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-2-21-8-10-23(11-9-21)24-12-14-25(15-13-24)26(30)28-16-18-29(19-17-28)27(31)32-20-22-6-4-3-5-7-22/h3-15H,2,16-20H2,1H3