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

Systemtic Name: N'-[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]-1H-pyrrole-2-carbohydrazide Openeye Name: N'-[4-(2,5-dimethylphenyl)-4-oxo-butanoyl]-1H-pyrrole-2-carbohydrazide CAS Name: N'-[4-(2,5-dimethylphenyl)-1,4-dioxobutyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: N'-[4-(2,5-dimethylphenyl)-4-oxobutanoyl]-1H-pyrrole-2-carbohydrazide Traditional Name: N'-[4-(2,5-dimethylphenyl)-4-keto-butanoyl]-1H-pyrrole-2-carbohydrazide Formula: C17H19N3O3 MolecularWeight: 313.35106

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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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3/c1-11-5-6-12(2)13(10-11)15(21)7-8-16(22)19-20-17(23)14-4-3-9-18-14/h3-6,9-10,18H,7-8H2,1-2H3,(H,19,22)(H,20,23)