3-methyl-2-(2-methylcyclohexa-1,5-dien-1-yl)-6-(phenylmethyl)benzoic acid

Systemtic Name: 3-methyl-2-(2-methylcyclohexa-1,5-dien-1-yl)-6-(phenylmethyl)benzoic acid Openeye Name: 6-benzyl-3-methyl-2-(2-methylcyclohexa-1,5-dien-1-yl)benzoic acid CAS Name: 3-methyl-2-(2-methyl-1-cyclohexa-1,5-dienyl)-6-(phenylmethyl)benzoic acid IUPAC Name: 6-benzyl-3-methyl-2-(2-methylcyclohexa-1,5-dien-1-yl)benzoic acid Traditional Name: 6-benzyl-3-methyl-2-(2-methylcyclohexa-1,5-dien-1-yl)benzoic acid Formula: C22H22O2 MolecularWeight: 318.40888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CCC1)C2=C(C=CC(=C2C(=O)O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=CCC1)C2=C(C=CC(=C2C(=O)O)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H22O2/c1-15-8-6-7-11-19(15)20-16(2)12-13-18(21(20)22(23)24)14-17-9-4-3-5-10-17/h3-5,7,9-13H,6,8,14H2,1-2H3,(H,23,24)