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2-(4-propan-2-ylphenyl)sulfanylterephthalic acid

2-(4-propan-2-ylphenyl)sulfanylterephthalic acid

Systemtic Name:2-(4-propan-2-ylphenyl)sulfanylterephthalic acid
Openeye Name:2-(4-isopropylphenyl)sulfanylterephthalic acid
CAS Name:2-[(4-propan-2-ylphenyl)thio]terephthalic acid
IUPAC Name:2-(4-propan-2-ylphenyl)sulfanylterephthalic acid
Traditional Name:2-(p-cumenylthio)terephthalic acid
Formula: C17H16O4S
MolecularWeight: 316.37154
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=C(C=CC(=C2)C(=O)O)C(=O)O


Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=C(C=CC(=C2)C(=O)O)C(=O)O


InChI

InChI=1S/C17H16O4S/c1-10(2)11-3-6-13(7-4-11)22-15-9-12(16(18)19)5-8-14(15)17(20)21/h3-10H,1-2H3,(H,18,19)(H,20,21)


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