(phenylmethyl) 4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: benzyl 4-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-3-oxo-piperazine-1-carboxylate CAS Name: 4-[4-[(1-cyclopentyl-4-piperidinyl)oxy]phenyl]-3-oxo-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-3-oxopiperazine-1-carboxylate Traditional Name: 4-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-3-keto-piperazine-1-carboxylic acid benzyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4CCN(CC4=O)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4CCN(CC4=O)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H35N3O4/c32-27-20-30(28(33)34-21-22-6-2-1-3-7-22)18-19-31(27)24-10-12-25(13-11-24)35-26-14-16-29(17-15-26)23-8-4-5-9-23/h1-3,6-7,10-13,23,26H,4-5,8-9,14-21H2