4-chloranyl-3-propan-2-ylsulfanyl-benzoic acid

Systemtic Name: 4-chloranyl-3-propan-2-ylsulfanyl-benzoic acid Openeye Name: 4-chloro-3-isopropylsulfanyl-benzoic acid CAS Name: 4-chloro-3-(propan-2-ylthio)benzoic acid IUPAC Name: 4-chloro-3-propan-2-ylsulfanylbenzoic acid Traditional Name: 4-chloro-3-(isopropylthio)benzoic acid Formula: C10H11ClO2S MolecularWeight: 230.71114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC(=C1)C(=O)O)Cl

Isomeric SMILES

CC(C)SC1=C(C=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C10H11ClO2S/c1-6(2)14-9-5-7(10(12)13)3-4-8(9)11/h3-6H,1-2H3,(H,12,13)