3-[[2-[(4-oxidanyl-4-oxidanylidene-but-2-enoyl)amino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[2-[(4-oxidanyl-4-oxidanylidene-but-2-enoyl)amino]phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[2-[(4-hydroxy-4-oxo-but-2-enoyl)amino]benzoyl]amino]benzoic acid CAS Name: 3-[[[2-[(4-hydroxy-1,4-dioxobut-2-enyl)amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-[(4-hydroxy-4-oxobut-2-enoyl)amino]benzoyl]amino]benzoic acid Traditional Name: 3-[[2-[(4-hydroxy-4-keto-but-2-enoyl)amino]benzoyl]amino]benzoic acid Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O)NC(=O)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O)NC(=O)C=CC(=O)O

InChI

InChI=1S/C18H14N2O6/c21-15(8-9-16(22)23)20-14-7-2-1-6-13(14)17(24)19-12-5-3-4-11(10-12)18(25)26/h1-10H,(H,19,24)(H,20,21)(H,22,23)(H,25,26)