N-(5-cyano-2,2-dimethyl-pentyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-(5-cyano-2,2-dimethyl-pentyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(5-cyano-2,2-dimethyl-pentyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-(5-cyano-2,2-dimethylpentyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(5-cyano-2,2-dimethylpentyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(5-cyano-2,2-dimethyl-pentyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC#N)CNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C)(CCCC#N)CNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C16H22N2O4S/c1-16(2,7-3-4-8-17)12-18-23(19,20)13-5-6-14-15(11-13)22-10-9-21-14/h5-6,11,18H,3-4,7,9-10,12H2,1-2H3