4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(2-methylphenyl)benzoic acid

Systemtic Name: 4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(2-methylphenyl)benzoic acid Openeye Name: 4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(o-tolyl)benzoic acid CAS Name: 4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(2-methylphenyl)benzoic acid IUPAC Name: 4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(2-methylphenyl)benzoic acid Traditional Name: 4-[(3-chlorophenyl)-(3-cyclohexylpropoxy)methyl]-2-(o-tolyl)benzoic acid Formula: C30H33ClO3 MolecularWeight: 477.03422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CC(=CC=C3)Cl)OCCCC4CCCCC4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3=CC(=CC=C3)Cl)OCCCC4CCCCC4)C(=O)O

InChI

InChI=1S/C30H33ClO3/c1-21-9-5-6-15-26(21)28-20-24(16-17-27(28)30(32)33)29(23-13-7-14-25(31)19-23)34-18-8-12-22-10-3-2-4-11-22/h5-7,9,13-17,19-20,22,29H,2-4,8,10-12,18H2,1H3,(H,32,33)