4-(1-oxidanylideneisochromen-4-yl)carbonylbenzoic acid

Systemtic Name: 4-(1-oxidanylideneisochromen-4-yl)carbonylbenzoic acid Openeye Name: 4-(1-oxoisochromene-4-carbonyl)benzoic acid CAS Name: 4-[oxo-(1-oxo-2-benzopyran-4-yl)methyl]benzoic acid IUPAC Name: 4-(1-oxoisochromene-4-carbonyl)benzoic acid Traditional Name: 4-(1-ketoisochromene-4-carbonyl)benzoic acid Formula: C17H10O5 MolecularWeight: 294.2583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=COC2=O)C(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=COC2=O)C(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H10O5/c18-15(10-5-7-11(8-6-10)16(19)20)14-9-22-17(21)13-4-2-1-3-12(13)14/h1-9H,(H,19,20)