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

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(1-phenylmethoxycarbonylpyrrolidin-2-yl)carbonylamino]butanoic acid Openeye Name: 4-amino-2-[(1-benzyloxycarbonylpyrrolidine-2-carbonyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-4-oxo-2-[[oxo-(1-phenylmethoxycarbonyl-2-pyrrolidinyl)methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]butanoic acid Traditional Name: 4-amino-2-[(1-carbobenzoxyprolyl)amino]-4-keto-butyric acid Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C17H21N3O6/c18-14(21)9-12(16(23)24)19-15(22)13-7-4-8-20(13)17(25)26-10-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-10H2,(H2,18,21)(H,19,22)(H,23,24)