[1-[[4-cyano-1-methyl-2-(phenylmethyl)piperidin-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[[4-cyano-1-methyl-2-(phenylmethyl)piperidin-4-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl] N-(phenylmethyl)carbamate Openeye Name: [1-[(2-benzyl-4-cyano-1-methyl-4-piperidyl)carbamoyl]-3-methyl-butyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[[4-cyano-1-methyl-2-(phenylmethyl)-4-piperidinyl]amino]-4-methyl-1-oxopentan-2-yl] ester IUPAC Name: [1-[(2-benzyl-4-cyano-1-methylpiperidin-4-yl)amino]-4-methyl-1-oxopentan-2-yl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [1-[(2-benzyl-4-cyano-1-methyl-4-piperidyl)carbamoyl]-3-methyl-butyl] ester Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1(CCN(C(C1)CC2=CC=CC=C2)C)C#N)OC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC1(CCN(C(C1)CC2=CC=CC=C2)C)C#N)OC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C28H36N4O3/c1-21(2)16-25(35-27(34)30-19-23-12-8-5-9-13-23)26(33)31-28(20-29)14-15-32(3)24(18-28)17-22-10-6-4-7-11-22/h4-13,21,24-25H,14-19H2,1-3H3,(H,30,34)(H,31,33)