N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-pyrrolidin-1-ylsulfonyl-benzofuran-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-(1-pyrrolidinylsulfonyl)-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-piperonyl-5-pyrrolidinosulfonyl-coumarilamide Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N2O6S/c1-14-17-11-16(31(26,27)24-8-2-3-9-24)5-7-18(17)30-21(14)22(25)23-12-15-4-6-19-20(10-15)29-13-28-19/h4-7,10-11H,2-3,8-9,12-13H2,1H3,(H,23,25)