2-[[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]pyrrolidin-1-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]pyrrolidin-1-yl]carbonylamino]benzoic acid Openeye Name: 2-[[2-[(2-amino-1-benzyl-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]amino]benzoic acid CAS Name: 2-[[[2-[[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]-1-pyrrolidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)carbamoyl]pyrrolidine-1-carbonyl]amino]benzoic acid Traditional Name: 2-[[2-[(2-amino-1-benzyl-2-keto-ethyl)carbamoyl]pyrrolidine-1-carbonyl]amino]benzoic acid Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC2=CC=CC=C2C(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)NC2=CC=CC=C2C(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C22H24N4O5/c23-19(27)17(13-14-7-2-1-3-8-14)24-20(28)18-11-6-12-26(18)22(31)25-16-10-5-4-9-15(16)21(29)30/h1-5,7-10,17-18H,6,11-13H2,(H2,23,27)(H,24,28)(H,25,31)(H,29,30)