ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[[2-keto-2-(piperonylamino)ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H23N3O7S MolecularWeight: 437.46682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NCC2=CC3=C(C=C2)OCO3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NCC2=CC3=C(C=C2)OCO3)C)C

InChI

InChI=1S/C19H23N3O7S/c1-4-27-19(24)17-11(2)22-12(3)18(17)30(25,26)21-9-16(23)20-8-13-5-6-14-15(7-13)29-10-28-14/h5-7,21-22H,4,8-10H2,1-3H3,(H,20,23)