1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxylic acid

Systemtic Name: 1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxylic acid Openeye Name: 1-oxo-3-phenyl-isochromane-6-carboxylic acid CAS Name: 1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxylic acid IUPAC Name: 1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxylic acid Traditional Name: 1-keto-3-phenyl-isochroman-6-carboxylic acid Formula: C16H12O4 MolecularWeight: 268.26408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H12O4/c17-15(18)11-6-7-13-12(8-11)9-14(20-16(13)19)10-4-2-1-3-5-10/h1-8,14H,9H2,(H,17,18)