6-[3-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propyl]-2,3-dihydro-1H-indene-5-carboxylic acid

Systemtic Name: 6-[3-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propyl]-2,3-dihydro-1H-indene-5-carboxylic acid Openeye Name: 6-(2-benzyl-3-hydroxy-3-oxo-propyl)indane-5-carboxylic acid CAS Name: 6-[3-hydroxy-3-oxo-2-(phenylmethyl)propyl]-2,3-dihydro-1H-indene-5-carboxylic acid IUPAC Name: 6-(2-benzyl-3-hydroxy-3-oxopropyl)-2,3-dihydro-1H-indene-5-carboxylic acid Traditional Name: 6-(2-benzyl-3-hydroxy-3-keto-propyl)indane-5-carboxylic acid Formula: C20H20O4 MolecularWeight: 324.3704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C(=C2)CC(CC3=CC=CC=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C(=C2)CC(CC3=CC=CC=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H20O4/c21-19(22)17(9-13-5-2-1-3-6-13)11-16-10-14-7-4-8-15(14)12-18(16)20(23)24/h1-3,5-6,10,12,17H,4,7-9,11H2,(H,21,22)(H,23,24)