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

Systemtic Name: N-(6-cyano-1,3-benzodioxol-5-yl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-cyano-1,3-benzodioxol-5-yl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-cyano-1,3-benzodioxol-5-yl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-cyano-1,3-benzodioxol-5-yl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-cyano-1,3-benzodioxol-5-yl)-3-piperidinosulfonyl-benzamide Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3C#N)OCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3C#N)OCO4

InChI

InChI=1S/C20H19N3O5S/c21-12-15-10-18-19(28-13-27-18)11-17(15)22-20(24)14-5-4-6-16(9-14)29(25,26)23-7-2-1-3-8-23/h4-6,9-11H,1-3,7-8,13H2,(H,22,24)