1-[methyl-[3-[(4-nitrophenoxy)carbonylamino]-2-oxidanylidene-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[methyl-[3-[(4-nitrophenoxy)carbonylamino]-2-oxidanylidene-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[methyl-[3-[(4-nitrophenoxy)carbonylamino]-2-oxo-4-phenyl-butyl]carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[methyl-[3-[[(4-nitrophenoxy)-oxomethyl]amino]-2-oxo-4-phenylbutyl]amino]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[methyl-[3-[(4-nitrophenoxy)carbonylamino]-2-oxo-4-phenylbutyl]carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[[2-keto-3-[(4-nitrophenoxy)carbonylamino]-4-phenyl-butyl]-methyl-carbamoyl]proline Formula: C24H26N4O8 MolecularWeight: 498.48524

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N3CCCC3C(=O)O

Isomeric SMILES

CN(CC(=O)C(CC1=CC=CC=C1)NC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N3CCCC3C(=O)O

InChI

InChI=1S/C24H26N4O8/c1-26(24(33)27-13-5-8-20(27)22(30)31)15-21(29)19(14-16-6-3-2-4-7-16)25-23(32)36-18-11-9-17(10-12-18)28(34)35/h2-4,6-7,9-12,19-20H,5,8,13-15H2,1H3,(H,25,32)(H,30,31)