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2-[3-(2-methylphenyl)sulfinylphenyl]pentanoic acid

2-[3-(2-methylphenyl)sulfinylphenyl]pentanoic acid

Systemtic Name:2-[3-(2-methylphenyl)sulfinylphenyl]pentanoic acid
Openeye Name:2-[3-(o-tolylsulfinyl)phenyl]pentanoic acid
CAS Name:2-[3-(2-methylphenyl)sulfinylphenyl]pentanoic acid
IUPAC Name:2-[3-(2-methylphenyl)sulfinylphenyl]pentanoic acid
Traditional Name:2-[3-(o-tolylsulfinyl)phenyl]valeric acid
Formula: C18H20O3S
MolecularWeight: 316.4146
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC(=CC=C1)S(=O)C2=CC=CC=C2C)C(=O)O


Isomeric SMILES

CCCC(C1=CC(=CC=C1)S(=O)C2=CC=CC=C2C)C(=O)O


InChI

InChI=1S/C18H20O3S/c1-3-7-16(18(19)20)14-9-6-10-15(12-14)22(21)17-11-5-4-8-13(17)2/h4-6,8-12,16H,3,7H2,1-2H3,(H,19,20)


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