2-[2-(1-oxidanylideneisochromen-3-yl)ethoxycarbonyl]benzoic acid

Systemtic Name: 2-[2-(1-oxidanylideneisochromen-3-yl)ethoxycarbonyl]benzoic acid Openeye Name: 2-[2-(1-oxoisochromen-3-yl)ethoxycarbonyl]benzoic acid CAS Name: 2-[oxo-[2-(1-oxo-2-benzopyran-3-yl)ethoxy]methyl]benzoic acid IUPAC Name: 2-[2-(1-oxoisochromen-3-yl)ethoxycarbonyl]benzoic acid Traditional Name: 2-[2-(1-ketoisochromen-3-yl)ethoxycarbonyl]benzoic acid Formula: C19H14O6 MolecularWeight: 338.31086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H14O6/c20-17(21)15-7-3-4-8-16(15)18(22)24-10-9-13-11-12-5-1-2-6-14(12)19(23)25-13/h1-8,11H,9-10H2,(H,20,21)