2-[aminocarbonyl-[3-[aminocarbonyl-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)carbamoyl]phenyl]carbonyl-amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[aminocarbonyl-[3-[aminocarbonyl-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)carbamoyl]phenyl]carbonyl-amino]-2-phenyl-ethanoic acid Openeye Name: 2-[carbamoyl-[3-[carbamoyl-(2-hydroxy-2-oxo-1-phenyl-ethyl)carbamoyl]benzoyl]amino]-2-phenyl-acetic acid CAS Name: 2-[carbamoyl-[[3-[[carbamoyl-(2-hydroxy-2-oxo-1-phenylethyl)amino]-oxomethyl]phenyl]-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[carbamoyl-[3-[carbamoyl-(2-hydroxy-2-oxo-1-phenylethyl)carbamoyl]benzoyl]amino]-2-phenylacetic acid Traditional Name: 2-[carbamoyl-[3-[carbamoyl-(2-hydroxy-2-keto-1-phenyl-ethyl)carbamoyl]benzoyl]amino]-2-phenyl-acetic acid Formula: C26H22N4O8 MolecularWeight: 518.47488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)N(C(=O)C2=CC(=CC=C2)C(=O)N(C(C3=CC=CC=C3)C(=O)O)C(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)N(C(=O)C2=CC(=CC=C2)C(=O)N(C(C3=CC=CC=C3)C(=O)O)C(=O)N)C(=O)N

InChI

InChI=1S/C26H22N4O8/c27-25(37)29(19(23(33)34)15-8-3-1-4-9-15)21(31)17-12-7-13-18(14-17)22(32)30(26(28)38)20(24(35)36)16-10-5-2-6-11-16/h1-14,19-20H,(H2,27,37)(H2,28,38)(H,33,34)(H,35,36)