ethyl 3-cyano-3-[[4-methyl-2-[(phenylmethyl)carbamoyloxy]pentanoyl]amino]pyrrolidine-1-carboxylate

Systemtic Name: ethyl 3-cyano-3-[[4-methyl-2-[(phenylmethyl)carbamoyloxy]pentanoyl]amino]pyrrolidine-1-carboxylate Openeye Name: ethyl 3-[[2-(benzylcarbamoyloxy)-4-methyl-pentanoyl]amino]-3-cyano-pyrrolidine-1-carboxylate CAS Name: 3-cyano-3-[[4-methyl-1-oxo-2-[oxo-[(phenylmethyl)amino]methoxy]pentyl]amino]-1-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(benzylcarbamoyloxy)-4-methylpentanoyl]amino]-3-cyanopyrrolidine-1-carboxylate Traditional Name: 3-[[2-(benzylcarbamoyloxy)-4-methyl-pentanoyl]amino]-3-cyano-pyrrolidine-1-carboxylic acid ethyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(C1)(C#N)NC(=O)C(CC(C)C)OC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCC(C1)(C#N)NC(=O)C(CC(C)C)OC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H30N4O5/c1-4-30-21(29)26-11-10-22(14-23,15-26)25-19(27)18(12-16(2)3)31-20(28)24-13-17-8-6-5-7-9-17/h5-9,16,18H,4,10-13,15H2,1-3H3,(H,24,28)(H,25,27)