4-[bis(cyclohexylmethyl)phosphinothioylmethyl]-2-(2-methylphenyl)benzoic acid

Systemtic Name: 4-[bis(cyclohexylmethyl)phosphinothioylmethyl]-2-(2-methylphenyl)benzoic acid Openeye Name: 4-[bis(cyclohexylmethyl)phosphinothioylmethyl]-2-(o-tolyl)benzoic acid CAS Name: 4-[bis(cyclohexylmethyl)phosphinothioylmethyl]-2-(2-methylphenyl)benzoic acid IUPAC Name: 4-[bis(cyclohexylmethyl)phosphinothioylmethyl]-2-(2-methylphenyl)benzoic acid Traditional Name: 4-[bis(cyclohexylmethyl)thiophosphorylmethyl]-2-(o-tolyl)benzoic acid Formula: C29H39O2PS MolecularWeight: 482.657521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)CP(=S)(CC3CCCCC3)CC4CCCCC4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)CP(=S)(CC3CCCCC3)CC4CCCCC4)C(=O)O

InChI

InChI=1S/C29H39O2PS/c1-22-10-8-9-15-26(22)28-18-25(16-17-27(28)29(30)31)21-32(33,19-23-11-4-2-5-12-23)20-24-13-6-3-7-14-24/h8-10,15-18,23-24H,2-7,11-14,19-21H2,1H3,(H,30,31)