N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-methoxy-N-piperonyl-5-pyrrolidinosulfonyl-benzamide Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-26-17-7-5-15(29(24,25)22-8-2-3-9-22)11-16(17)20(23)21-12-14-4-6-18-19(10-14)28-13-27-18/h4-7,10-11H,2-3,8-9,12-13H2,1H3,(H,21,23)