[2-[[4-(phenylmethyl)-4-piperidin-1-yl-cyclohexyl]carbamoyl]phenyl]methyl benzoate

Systemtic Name: [2-[[4-(phenylmethyl)-4-piperidin-1-yl-cyclohexyl]carbamoyl]phenyl]methyl benzoate Openeye Name: [2-[[4-benzyl-4-(1-piperidyl)cyclohexyl]carbamoyl]phenyl]methyl benzoate CAS Name: benzoic acid [2-[oxo-[[4-(phenylmethyl)-4-(1-piperidinyl)cyclohexyl]amino]methyl]phenyl]methyl ester IUPAC Name: [2-[(4-benzyl-4-piperidin-1-ylcyclohexyl)carbamoyl]phenyl]methyl benzoate Traditional Name: benzoic acid [2-[(4-benzyl-4-piperidino-cyclohexyl)carbamoyl]benzyl] ester Formula: C33H38N2O3 MolecularWeight: 510.66642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCC(CC2)NC(=O)C3=CC=CC=C3COC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2(CCC(CC2)NC(=O)C3=CC=CC=C3COC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C33H38N2O3/c36-31(30-17-9-8-16-28(30)25-38-32(37)27-14-6-2-7-15-27)34-29-18-20-33(21-19-29,35-22-10-3-11-23-35)24-26-12-4-1-5-13-26/h1-2,4-9,12-17,29H,3,10-11,18-25H2,(H,34,36)