5-(1-acetamido-3-ethyl-pentyl)-4-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-1-(phenylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-3-ethyl-pentyl)-4-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-1-(phenylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(1-acetamido-3-ethyl-pentyl)-1-benzyl-4-[(E)-N-hydroxy-C-methyl-carbonimidoyl]pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-3-ethylpentyl)-4-[(1E)-1-hydroxyiminoethyl]-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-3-ethylpentyl)-1-benzyl-4-[(E)-N-hydroxy-C-methylcarbonimidoyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-3-ethyl-pentyl)-4-acetohydroximoyl-1-benzyl-proline Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC(C1C(CC(N1CC2=CC=CC=C2)C(=O)O)C(=NO)C)NC(=O)C

Isomeric SMILES

CCC(CC)CC(C1C(CC(N1CC2=CC=CC=C2)C(=O)O)/C(=N/O)/C)NC(=O)C

InChI

InChI=1S/C23H35N3O4/c1-5-17(6-2)12-20(24-16(4)27)22-19(15(3)25-30)13-21(23(28)29)26(22)14-18-10-8-7-9-11-18/h7-11,17,19-22,30H,5-6,12-14H2,1-4H3,(H,24,27)(H,28,29)/b25-15+