3-[[6-[(3-carboxyphenyl)carbamoyl]pyridin-2-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[6-[(3-carboxyphenyl)carbamoyl]pyridin-2-yl]carbonylamino]benzoic acid Openeye Name: 3-[[6-[(3-carboxyphenyl)carbamoyl]pyridine-2-carbonyl]amino]benzoic acid CAS Name: 3-[[[6-[(3-carboxyanilino)-oxomethyl]-2-pyridinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[6-[(3-carboxyphenyl)carbamoyl]pyridine-2-carbonyl]amino]benzoic acid Traditional Name: 3-[[6-[(3-carboxyphenyl)carbamoyl]picolinoyl]amino]benzoic acid Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NC(=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NC(=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C21H15N3O6/c25-18(22-14-6-1-4-12(10-14)20(27)28)16-8-3-9-17(24-16)19(26)23-15-7-2-5-13(11-15)21(29)30/h1-11H,(H,22,25)(H,23,26)(H,27,28)(H,29,30)