methyl 3-methyl-1-phenyl-buta-1,2-diene-1-sulfinate

Systemtic Name: methyl 3-methyl-1-phenyl-buta-1,2-diene-1-sulfinate Openeye Name: methyl 3-methyl-1-phenyl-buta-1,2-diene-1-sulfinate CAS Name: 3-methyl-1-phenyl-1-buta-1,2-dienesulfinic acid IUPAC Name: methyl 3-methyl-1-phenylbuta-1,2-diene-1-sulfinate Traditional Name: 3-methyl-1-phenyl-buta-1,2-diene-1-sulfinic acid methyl ester Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O2S/c1-10(2)9-12(15(13)14-3)11-7-5-4-6-8-11/h4-8H,1-3H3