[2-[1-[4-[[4-(4-cyanophenyl)phenyl]carbonylamino]butyl]piperidin-4-yl]-5-methyl-phenyl] ethanoate

Systemtic Name: [2-[1-[4-[[4-(4-cyanophenyl)phenyl]carbonylamino]butyl]piperidin-4-yl]-5-methyl-phenyl] ethanoate Openeye Name: [2-[1-[4-[[4-(4-cyanophenyl)benzoyl]amino]butyl]-4-piperidyl]-5-methyl-phenyl] acetate CAS Name: acetic acid [2-[1-[4-[[[4-(4-cyanophenyl)phenyl]-oxomethyl]amino]butyl]-4-piperidinyl]-5-methylphenyl] ester IUPAC Name: [2-[1-[4-[[4-(4-cyanophenyl)benzoyl]amino]butyl]piperidin-4-yl]-5-methylphenyl] acetate Traditional Name: acetic acid [2-[1-[4-[[4-(4-cyanophenyl)benzoyl]amino]butyl]-4-piperidyl]-5-methyl-phenyl] ester Formula: C32H35N3O3 MolecularWeight: 509.6386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2CCN(CC2)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2CCN(CC2)CCCCNC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N)OC(=O)C

InChI

InChI=1S/C32H35N3O3/c1-23-5-14-30(31(21-23)38-24(2)36)28-15-19-35(20-16-28)18-4-3-17-34-32(37)29-12-10-27(11-13-29)26-8-6-25(22-33)7-9-26/h5-14,21,28H,3-4,15-20H2,1-2H3,(H,34,37)