1-(1-isocyanobutylsulfonyl)-4-methyl-benzene

Systemtic Name: 1-(1-isocyanobutylsulfonyl)-4-methyl-benzene Openeye Name: 1-(1-isocyanobutylsulfonyl)-4-methyl-benzene CAS Name: 1-(1-isocyanobutylsulfonyl)-4-methylbenzene IUPAC Name: 1-(1-isocyanobutylsulfonyl)-4-methylbenzene Traditional Name: 1-(1-isocyanobutylsulfonyl)-4-methyl-benzene Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC([N+]#[C-])S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCC([N+]#[C-])S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C12H15NO2S/c1-4-5-12(13-3)16(14,15)11-8-6-10(2)7-9-11/h6-9,12H,4-5H2,1-2H3