6-[(E)-but-2-enyl]-2,3,4-trimethyl-benzenesulfinic acid

Systemtic Name: 6-[(E)-but-2-enyl]-2,3,4-trimethyl-benzenesulfinic acid Openeye Name: 6-[(E)-but-2-enyl]-2,3,4-trimethyl-benzenesulfinic acid CAS Name: 6-[(E)-but-2-enyl]-2,3,4-trimethylbenzenesulfinic acid IUPAC Name: 6-[(E)-but-2-enyl]-2,3,4-trimethylbenzenesulfinic acid Traditional Name: 6-[(E)-but-2-enyl]-2,3,4-trimethyl-benzenesulfinic acid Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1=C(C(=C(C(=C1)C)C)C)S(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2S/c1-5-6-7-12-8-9(2)10(3)11(4)13(12)16(14)15/h5-6,8H,7H2,1-4H3,(H,14,15)/b6-5+