1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propan-1-one Openeye Name: 1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propan-1-one CAS Name: 1-(1-azepanyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propan-1-one Traditional Name: 1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propan-1-one Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCCN(CC1)C(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H23NO5S/c19-17(18-8-3-1-2-4-9-18)7-12-24(20,21)14-5-6-15-16(13-14)23-11-10-22-15/h5-6,13H,1-4,7-12H2