N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-piperidinosulfonyl-N-piperonyl-pyrrole-2-carboxamide Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C19H23N3O5S/c1-21-12-15(28(24,25)22-7-3-2-4-8-22)10-16(21)19(23)20-11-14-5-6-17-18(9-14)27-13-26-17/h5-6,9-10,12H,2-4,7-8,11,13H2,1H3,(H,20,23)