(E)-3-(4-methylphenyl)sulfonyl-6-phenyl-hex-5-enoic acid

Systemtic Name: (E)-3-(4-methylphenyl)sulfonyl-6-phenyl-hex-5-enoic acid Openeye Name: (E)-6-phenyl-3-(p-tolylsulfonyl)hex-5-enoic acid CAS Name: (E)-3-(4-methylphenyl)sulfonyl-6-phenyl-5-hexenoic acid IUPAC Name: (E)-3-(4-methylphenyl)sulfonyl-6-phenylhex-5-enoic acid Traditional Name: (E)-6-phenyl-3-tosyl-hex-5-enoic acid Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC=CC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C/C=C/C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C19H20O4S/c1-15-10-12-17(13-11-15)24(22,23)18(14-19(20)21)9-5-8-16-6-3-2-4-7-16/h2-8,10-13,18H,9,14H2,1H3,(H,20,21)/b8-5+