N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-piperonylamide Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-26-17-8-6-15(29(24,25)22-9-3-2-4-10-22)12-16(17)21-20(23)14-5-7-18-19(11-14)28-13-27-18/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,21,23)