1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene

Systemtic Name: 1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene Openeye Name: 1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene CAS Name: 1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene IUPAC Name: 1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene Traditional Name: 1,3-dimethyl-5-(prop-1-ynylsulfonylmethyl)benzene Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC#CS(=O)(=O)CC1=CC(=CC(=C1)C)C

Isomeric SMILES

CC#CS(=O)(=O)CC1=CC(=CC(=C1)C)C

InChI

InChI=1S/C12H14O2S/c1-4-5-15(13,14)9-12-7-10(2)6-11(3)8-12/h6-8H,9H2,1-3H3