3-[(1-oxidanylideneisochromen-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(1-oxidanylideneisochromen-3-yl)carbonylamino]benzoic acid Openeye Name: 3-[(1-oxoisochromene-3-carbonyl)amino]benzoic acid CAS Name: 3-[[oxo-(1-oxo-2-benzopyran-3-yl)methyl]amino]benzoic acid IUPAC Name: 3-[(1-oxoisochromene-3-carbonyl)amino]benzoic acid Traditional Name: 3-[(1-ketoisochromene-3-carbonyl)amino]benzoic acid Formula: C17H11NO5 MolecularWeight: 309.27294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)C(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)C(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H11NO5/c19-15(18-12-6-3-5-11(8-12)16(20)21)14-9-10-4-1-2-7-13(10)17(22)23-14/h1-9H,(H,18,19)(H,20,21)