(phenylmethyl) N-[3-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-4-methyl-phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-4-methyl-phenyl]carbamate Openeye Name: benzyl N-[3-[4-(4-cyanophenyl)piperidine-1-carbonyl]-4-methyl-phenyl]carbamate CAS Name: N-[3-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-4-methylphenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[4-(4-cyanophenyl)piperidine-1-carbonyl]-4-methylphenyl]carbamate Traditional Name: N-[3-[4-(4-cyanophenyl)piperidine-1-carbonyl]-4-methyl-phenyl]carbamic acid benzyl ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)OCC2=CC=CC=C2)C(=O)N3CCC(CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)OCC2=CC=CC=C2)C(=O)N3CCC(CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H27N3O3/c1-20-7-12-25(30-28(33)34-19-22-5-3-2-4-6-22)17-26(20)27(32)31-15-13-24(14-16-31)23-10-8-21(18-29)9-11-23/h2-12,17,24H,13-16,19H2,1H3,(H,30,33)