(phenylmethyl) N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2,4-dimethyl-phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2,4-dimethyl-phenyl]carbamate Openeye Name: benzyl N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethyl-phenyl]carbamate CAS Name: N-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2,4-dimethylphenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethylphenyl]carbamate Traditional Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2,4-dimethyl-phenyl]carbamic acid benzyl ester Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C29H29N3O3/c1-20-16-21(2)27(31-29(34)35-19-23-6-4-3-5-7-23)17-26(20)28(33)32-14-12-25(13-15-32)24-10-8-22(18-30)9-11-24/h3-11,16-17,25H,12-15,19H2,1-2H3,(H,31,34)