4-azanyl-4-oxidanylidene-2-[(1-phenoxycarbonylpyrrolidin-2-yl)carbonylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(1-phenoxycarbonylpyrrolidin-2-yl)carbonylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[(1-phenoxycarbonylpyrrolidine-2-carbonyl)amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[oxo-[1-[oxo(phenoxy)methyl]-2-pyrrolidinyl]methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(1-phenoxycarbonylpyrrolidine-2-carbonyl)amino]butanoic acid Traditional Name: 4-amino-2-[(1-carbophenoxyprolyl)amino]-4-keto-butyric acid Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OC2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)OC2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C16H19N3O6/c17-13(20)9-11(15(22)23)18-14(21)12-7-4-8-19(12)16(24)25-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2,(H2,17,20)(H,18,21)(H,22,23)