(E)-2-[[benzamido(phenylcarbonyl)amino]methyl]-3-phenyl-but-2-enoic acid

Systemtic Name: (E)-2-[[benzamido(phenylcarbonyl)amino]methyl]-3-phenyl-but-2-enoic acid Openeye Name: (E)-2-[[benzamido(benzoyl)amino]methyl]-3-phenyl-but-2-enoic acid CAS Name: (E)-2-[[benzamido(benzoyl)amino]methyl]-3-phenyl-2-butenoic acid IUPAC Name: (E)-2-[[benzamido(benzoyl)amino]methyl]-3-phenylbut-2-enoic acid Traditional Name: (E)-2-[[benzamido(benzoyl)amino]methyl]-3-phenyl-but-2-enoic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CN(C(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C/C(=C(/CN(C(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2)\C(=O)O)/C3=CC=CC=C3

InChI

InChI=1S/C25H22N2O4/c1-18(19-11-5-2-6-12-19)22(25(30)31)17-27(24(29)21-15-9-4-10-16-21)26-23(28)20-13-7-3-8-14-20/h2-16H,17H2,1H3,(H,26,28)(H,30,31)/b22-18+