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

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H26N2O5S/c21-18-6-2-1-3-10-20(18)11-4-9-19-26(22,23)15-7-8-16-17(14-15)25-13-5-12-24-16/h7-8,14,19H,1-6,9-13H2