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

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-piperidinosulfonyl-benzamide Formula: C21H22N2O6S MolecularWeight: 430.47418

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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)N4CCCCC4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4)OCO2

InChI

InChI=1S/C21H22N2O6S/c1-14(24)17-11-19-20(29-13-28-19)12-18(17)22-21(25)15-6-5-7-16(10-15)30(26,27)23-8-3-2-4-9-23/h5-7,10-12H,2-4,8-9,13H2,1H3,(H,22,25)