N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-piperonylamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H24N2O6S/c1-2-27-18-9-7-16(13-20(18)30(25,26)23-10-4-3-5-11-23)22-21(24)15-6-8-17-19(12-15)29-14-28-17/h6-9,12-13H,2-5,10-11,14H2,1H3,(H,22,24)