4-bromanyl-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyl]-1-methyl-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyl]-1-methyl-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyl]-1-methyl-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-oxopropyl]-1-methyl-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyl]-1-methylpyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyl]-1-methyl-pyrrole-2-carbohydrazide Formula: C17H18BrN3O6S MolecularWeight: 472.31032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)Br

InChI

InChI=1S/C17H18BrN3O6S/c1-21-10-11(18)8-13(21)17(23)20-19-16(22)4-7-28(24,25)12-2-3-14-15(9-12)27-6-5-26-14/h2-3,8-10H,4-7H2,1H3,(H,19,22)(H,20,23)