N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-propyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-propyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-propyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-propyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-propyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-propyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C16H23NO6S2 MolecularWeight: 389.48692

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCCN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H23NO6S2/c1-2-7-17(13-6-10-24(18,19)12-13)25(20,21)14-4-5-15-16(11-14)23-9-3-8-22-15/h4-5,11,13H,2-3,6-10,12H2,1H3