cyclohexylmethyl 4-cyano-4-[[4-methyl-2-[(phenylmethyl)carbamoyloxy]pentanoyl]amino]piperidine-1-carboxylate

Systemtic Name: cyclohexylmethyl 4-cyano-4-[[4-methyl-2-[(phenylmethyl)carbamoyloxy]pentanoyl]amino]piperidine-1-carboxylate Openeye Name: cyclohexylmethyl 4-[[2-(benzylcarbamoyloxy)-4-methyl-pentanoyl]amino]-4-cyano-piperidine-1-carboxylate CAS Name: 4-cyano-4-[[4-methyl-1-oxo-2-[oxo-[(phenylmethyl)amino]methoxy]pentyl]amino]-1-piperidinecarboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-[[2-(benzylcarbamoyloxy)-4-methylpentanoyl]amino]-4-cyanopiperidine-1-carboxylate Traditional Name: 4-[[2-(benzylcarbamoyloxy)-4-methyl-pentanoyl]amino]-4-cyano-piperidine-1-carboxylic acid cyclohexylmethyl ester Formula: C28H40N4O5 MolecularWeight: 512.641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1(CCN(CC1)C(=O)OCC2CCCCC2)C#N)OC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC1(CCN(CC1)C(=O)OCC2CCCCC2)C#N)OC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C28H40N4O5/c1-21(2)17-24(37-26(34)30-18-22-9-5-3-6-10-22)25(33)31-28(20-29)13-15-32(16-14-28)27(35)36-19-23-11-7-4-8-12-23/h3,5-6,9-10,21,23-24H,4,7-8,11-19H2,1-2H3,(H,30,34)(H,31,33)