2-[(4-propan-2-ylphenyl)methylsulfonyl]ethanoic acid

Systemtic Name: 2-[(4-propan-2-ylphenyl)methylsulfonyl]ethanoic acid Openeye Name: 2-[(4-isopropylphenyl)methylsulfonyl]acetic acid CAS Name: 2-[(4-propan-2-ylphenyl)methylsulfonyl]acetic acid IUPAC Name: 2-[(4-propan-2-ylphenyl)methylsulfonyl]acetic acid Traditional Name: 2-(4-isopropylbenzyl)sulfonylacetic acid Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CS(=O)(=O)CC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CS(=O)(=O)CC(=O)O

InChI

InChI=1S/C12H16O4S/c1-9(2)11-5-3-10(4-6-11)7-17(15,16)8-12(13)14/h3-6,9H,7-8H2,1-2H3,(H,13,14)