(E)-1-phenylbut-1-ene-2-sulfonic acid

Systemtic Name: (E)-1-phenylbut-1-ene-2-sulfonic acid Openeye Name: (E)-1-phenylbut-1-ene-2-sulfonic acid CAS Name: (E)-1-phenyl-1-butene-2-sulfonic acid IUPAC Name: (E)-1-phenylbut-1-ene-2-sulfonic acid Traditional Name: (E)-1-phenylbut-1-ene-2-sulfonic acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CC/C(=C\C1=CC=CC=C1)/S(=O)(=O)O

InChI

InChI=1S/C10H12O3S/c1-2-10(14(11,12)13)8-9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,11,12,13)/b10-8+