3-[[2-azanyl-4-oxidanylidene-4-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: 3-[[2-azanyl-4-oxidanylidene-4-(phenylmethoxycarbonylamino)butanoyl]amino]-2-oxidanyl-4-phenyl-butanoic acid Openeye Name: 3-[[2-amino-4-(benzyloxycarbonylamino)-4-oxo-butanoyl]amino]-2-hydroxy-4-phenyl-butanoic acid CAS Name: 3-[[2-amino-1,4-dioxo-4-(phenylmethoxycarbonylamino)butyl]amino]-2-hydroxy-4-phenylbutanoic acid IUPAC Name: 3-[[2-amino-4-oxo-4-(phenylmethoxycarbonylamino)butanoyl]amino]-2-hydroxy-4-phenylbutanoic acid Traditional Name: 3-[[2-amino-4-(benzyloxycarbonylamino)-4-keto-butanoyl]amino]-2-hydroxy-4-phenyl-butyric acid Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O7/c23-16(12-18(26)25-22(31)32-13-15-9-5-2-6-10-15)20(28)24-17(19(27)21(29)30)11-14-7-3-1-4-8-14/h1-10,16-17,19,27H,11-13,23H2,(H,24,28)(H,29,30)(H,25,26,31)