1-butyl-4-methylsulfonyl-benzene

Systemtic Name: 1-butyl-4-methylsulfonyl-benzene Openeye Name: 1-butyl-4-methylsulfonyl-benzene CAS Name: 1-butyl-4-methylsulfonylbenzene IUPAC Name: 1-butyl-4-methylsulfonylbenzene Traditional Name: 1-butyl-4-mesyl-benzene Formula: C11H16O2S MolecularWeight: 212.30854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C11H16O2S/c1-3-4-5-10-6-8-11(9-7-10)14(2,12)13/h6-9H,3-5H2,1-2H3