(phenylmethyl) 2-[cyano(methyl)carbamoyl]-4-methyl-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[cyano(methyl)carbamoyl]-4-methyl-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[cyano(methyl)carbamoyl]-4-hydroxy-4-methyl-pyrrolidine-1-carboxylate CAS Name: 2-[[cyano(methyl)amino]-oxomethyl]-4-hydroxy-4-methyl-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[cyano(methyl)carbamoyl]-4-hydroxy-4-methylpyrrolidine-1-carboxylate Traditional Name: 2-[cyano(methyl)carbamoyl]-4-hydroxy-4-methyl-pyrrolidine-1-carboxylic acid benzyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)N(C)C#N)O

Isomeric SMILES

CC1(CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)N(C)C#N)O

InChI

InChI=1S/C16H19N3O4/c1-16(22)8-13(14(20)18(2)11-17)19(10-16)15(21)23-9-12-6-4-3-5-7-12/h3-7,13,22H,8-10H2,1-2H3