(5E)-N-(3-iodanylphenyl)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: (5E)-N-(3-iodanylphenyl)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Openeye Name: (5E)-N-(3-iodophenyl)-5-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide CAS Name: (5E)-N-(3-iodophenyl)-5-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxamide IUPAC Name: (5E)-N-(3-iodophenyl)-5-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Traditional Name: (5E)-N-(3-iodophenyl)-5-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carboxamide Formula: C17H14IN3O2 MolecularWeight: 419.21643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2C=C(NN2)C(=O)NC3=CC(=CC=C3)I)C1=O

Isomeric SMILES

CC1=CC=C/C(=C\2/C=C(NN2)C(=O)NC3=CC(=CC=C3)I)/C1=O

InChI

InChI=1S/C17H14IN3O2/c1-10-4-2-7-13(16(10)22)14-9-15(21-20-14)17(23)19-12-6-3-5-11(18)8-12/h2-9,20-21H,1H3,(H,19,23)/b14-13+