N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(1-methylhexyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-heptan-2-yl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(1-methylhexyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NS(=O)(=O)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

CCCCCC(C)NS(=O)(=O)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C16H25NO4S/c1-3-4-5-7-13(2)17-22(18,19)14-8-9-15-16(12-14)21-11-6-10-20-15/h8-9,12-13,17H,3-7,10-11H2,1-2H3