5-(1,3-diphenylbutyl)-3-[(2-methylphenyl)methyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-(1,3-diphenylbutyl)-3-[(2-methylphenyl)methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-(1,3-diphenylbutyl)-2-hydroxy-3-(o-tolylmethyl)benzoic acid CAS Name: 5-(1,3-diphenylbutyl)-2-hydroxy-3-[(2-methylphenyl)methyl]benzoic acid IUPAC Name: 5-(1,3-diphenylbutyl)-2-hydroxy-3-[(2-methylphenyl)methyl]benzoic acid Traditional Name: 5-(1,3-diphenylbutyl)-2-hydroxy-3-(2-methylbenzyl)benzoic acid Formula: C31H30O3 MolecularWeight: 450.5681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=C(C(=CC(=C2)C(CC(C)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1CC2=C(C(=CC(=C2)C(CC(C)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O)O

InChI

InChI=1S/C31H30O3/c1-21-11-9-10-16-25(21)18-27-19-26(20-29(30(27)32)31(33)34)28(24-14-7-4-8-15-24)17-22(2)23-12-5-3-6-13-23/h3-16,19-20,22,28,32H,17-18H2,1-2H3,(H,33,34)