2-[aminocarbonyl-[7-[aminocarbonyl-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-7-oxidanylidene-heptanoyl]amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[aminocarbonyl-[7-[aminocarbonyl-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)amino]-7-oxidanylidene-heptanoyl]amino]-2-phenyl-ethanoic acid Openeye Name: 2-[carbamoyl-[7-[carbamoyl-(2-hydroxy-2-oxo-1-phenyl-ethyl)amino]-7-oxo-heptanoyl]amino]-2-phenyl-acetic acid CAS Name: 2-[carbamoyl-[7-[carbamoyl-(2-hydroxy-2-oxo-1-phenylethyl)amino]-1,7-dioxoheptyl]amino]-2-phenylacetic acid IUPAC Name: 2-[carbamoyl-[7-[carbamoyl-(2-hydroxy-2-oxo-1-phenylethyl)amino]-7-oxoheptanoyl]amino]-2-phenylacetic acid Traditional Name: 2-[carbamoyl-[7-[carbamoyl-(2-hydroxy-2-keto-1-phenyl-ethyl)amino]-7-keto-heptanoyl]amino]-2-phenyl-acetic acid Formula: C25H28N4O8 MolecularWeight: 512.51182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N4O8/c26-24(36)28(20(22(32)33)16-10-4-1-5-11-16)18(30)14-8-3-9-15-19(31)29(25(27)37)21(23(34)35)17-12-6-2-7-13-17/h1-2,4-7,10-13,20-21H,3,8-9,14-15H2,(H2,26,36)(H2,27,37)(H,32,33)(H,34,35)