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

Systemtic Name: ethyl 4-cyano-4-[[4-methyl-2-[(phenylmethyl)carbamoyloxy]pentanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C23H32N4O5 MolecularWeight: 444.52398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)(C#N)NC(=O)C(CC(C)C)OC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)(C#N)NC(=O)C(CC(C)C)OC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C23H32N4O5/c1-4-31-22(30)27-12-10-23(16-24,11-13-27)26-20(28)19(14-17(2)3)32-21(29)25-15-18-8-6-5-7-9-18/h5-9,17,19H,4,10-15H2,1-3H3,(H,25,29)(H,26,28)