2-[[4-[(2-carboxyphenyl)carbonylamino]-1,2,5-oxadiazol-3-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[(2-carboxyphenyl)carbonylamino]-1,2,5-oxadiazol-3-yl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[(2-carboxybenzoyl)amino]-1,2,5-oxadiazol-3-yl]carbamoyl]benzoic acid CAS Name: 2-[[[4-[[(2-carboxyphenyl)-oxomethyl]amino]-1,2,5-oxadiazol-3-yl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[(2-carboxybenzoyl)amino]-1,2,5-oxadiazol-3-yl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[(2-carboxybenzoyl)amino]furazan-3-yl]carbamoyl]benzoic acid Formula: C18H12N4O7 MolecularWeight: 396.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NON=C2NC(=O)C3=CC=CC=C3C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NON=C2NC(=O)C3=CC=CC=C3C(=O)O)C(=O)O

InChI

InChI=1S/C18H12N4O7/c23-15(9-5-1-3-7-11(9)17(25)26)19-13-14(22-29-21-13)20-16(24)10-6-2-4-8-12(10)18(27)28/h1-8H,(H,25,26)(H,27,28)(H,19,21,23)(H,20,22,24)