2-[5-methyl-3-(2-methylpropyl)hex-2-enyl]benzenesulfinic acid

Systemtic Name: 2-[5-methyl-3-(2-methylpropyl)hex-2-enyl]benzenesulfinic acid Openeye Name: 2-(3-isobutyl-5-methyl-hex-2-enyl)benzenesulfinic acid CAS Name: 2-[5-methyl-3-(2-methylpropyl)hex-2-enyl]benzenesulfinic acid IUPAC Name: 2-[5-methyl-3-(2-methylpropyl)hex-2-enyl]benzenesulfinic acid Traditional Name: 2-(3-isobutyl-5-methyl-hex-2-enyl)benzenesulfinic acid Formula: C17H26O2S MolecularWeight: 294.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=CCC1=CC=CC=C1S(=O)O)CC(C)C

Isomeric SMILES

CC(C)CC(=CCC1=CC=CC=C1S(=O)O)CC(C)C

InChI

InChI=1S/C17H26O2S/c1-13(2)11-15(12-14(3)4)9-10-16-7-5-6-8-17(16)20(18)19/h5-9,13-14H,10-12H2,1-4H3,(H,18,19)