2-[4-(3-methylphenyl)sulfinylphenyl]hexanoic acid

Systemtic Name: 2-[4-(3-methylphenyl)sulfinylphenyl]hexanoic acid Openeye Name: 2-[4-(m-tolylsulfinyl)phenyl]hexanoic acid CAS Name: 2-[4-(3-methylphenyl)sulfinylphenyl]hexanoic acid IUPAC Name: 2-[4-(3-methylphenyl)sulfinylphenyl]hexanoic acid Traditional Name: 2-[4-(m-tolylsulfinyl)phenyl]hexanoic acid Formula: C19H22O3S MolecularWeight: 330.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=C(C=C1)S(=O)C2=CC=CC(=C2)C)C(=O)O

Isomeric SMILES

CCCCC(C1=CC=C(C=C1)S(=O)C2=CC=CC(=C2)C)C(=O)O

InChI

InChI=1S/C19H22O3S/c1-3-4-8-18(19(20)21)15-9-11-16(12-10-15)23(22)17-7-5-6-14(2)13-17/h5-7,9-13,18H,3-4,8H2,1-2H3,(H,20,21)