3-(azepan-1-ylsulfonyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(azepan-1-ylsulfonyl)benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1-azepanylsulfonyl)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(azepan-1-ylsulfonyl)benzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(azepan-1-ylsulfonyl)benzamide Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4)OCO2

InChI

InChI=1S/C22H24N2O6S/c1-15(25)18-12-20-21(30-14-29-20)13-19(18)23-22(26)16-7-6-8-17(11-16)31(27,28)24-9-4-2-3-5-10-24/h6-8,11-13H,2-5,9-10,14H2,1H3,(H,23,26)