3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propanoic acid Openeye Name: 3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propanoic acid CAS Name: 3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propanoic acid IUPAC Name: 3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propanoic acid Traditional Name: 3-[4-(3-methylbut-2-enylsulfonyl)phenyl]propionic acid Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O)C

Isomeric SMILES

CC(=CCS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O)C

InChI

InChI=1S/C14H18O4S/c1-11(2)9-10-19(17,18)13-6-3-12(4-7-13)5-8-14(15)16/h3-4,6-7,9H,5,8,10H2,1-2H3,(H,15,16)