4-bromanyl-N'-[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]-1H-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]-1H-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[4-(2,5-dimethylphenyl)-4-oxo-butanoyl]-1H-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[4-(2,5-dimethylphenyl)-1,4-dioxobutyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-bromo-N'-[4-(2,5-dimethylphenyl)-4-oxobutanoyl]-1H-pyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[4-(2,5-dimethylphenyl)-4-keto-butanoyl]-1H-pyrrole-2-carbohydrazide Formula: C17H18BrN3O3 MolecularWeight: 392.24712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NNC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NNC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C17H18BrN3O3/c1-10-3-4-11(2)13(7-10)15(22)5-6-16(23)20-21-17(24)14-8-12(18)9-19-14/h3-4,7-9,19H,5-6H2,1-2H3,(H,20,23)(H,21,24)