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

Systemtic Name: 2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-piperidinosulfonyl-benzamide Formula: C21H21ClN2O6S MolecularWeight: 464.91924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O6S/c1-13(25)15-10-19-20(30-12-29-19)11-18(15)23-21(26)16-9-14(5-6-17(16)22)31(27,28)24-7-3-2-4-8-24/h5-6,9-11H,2-4,7-8,12H2,1H3,(H,23,26)