2-[(1,1-dimethyl-3-oxidanylidene-2H-inden-2-yl)methyl]-3,5-dimethoxy-benzoic acid

Systemtic Name: 2-[(1,1-dimethyl-3-oxidanylidene-2H-inden-2-yl)methyl]-3,5-dimethoxy-benzoic acid Openeye Name: 2-[(1,1-dimethyl-3-oxo-indan-2-yl)methyl]-3,5-dimethoxy-benzoic acid CAS Name: 2-[(1,1-dimethyl-3-oxo-2H-inden-2-yl)methyl]-3,5-dimethoxybenzoic acid IUPAC Name: 2-[(1,1-dimethyl-3-oxo-2H-inden-2-yl)methyl]-3,5-dimethoxybenzoic acid Traditional Name: 2-[(3-keto-1,1-dimethyl-indan-2-yl)methyl]-3,5-dimethoxy-benzoic acid Formula: C21H22O5 MolecularWeight: 354.39638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)C2=CC=CC=C21)CC3=C(C=C(C=C3C(=O)O)OC)OC)C

Isomeric SMILES

CC1(C(C(=O)C2=CC=CC=C21)CC3=C(C=C(C=C3C(=O)O)OC)OC)C

InChI

InChI=1S/C21H22O5/c1-21(2)16-8-6-5-7-13(16)19(22)17(21)11-14-15(20(23)24)9-12(25-3)10-18(14)26-4/h5-10,17H,11H2,1-4H3,(H,23,24)