1-[(3-bromophenyl)methyl]-N'-[(3-methoxy-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N'-[(3-methoxy-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide Openeye Name: 1-[(3-bromophenyl)methyl]-N'-[(3-methoxy-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide CAS Name: 1-[(3-bromophenyl)methyl]-N'-[(3-methoxy-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-pyrazolecarbohydrazide IUPAC Name: 1-[(3-bromophenyl)methyl]-N'-[(3-methoxy-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide Traditional Name: 1-(3-bromobenzyl)-N'-[(6-keto-3-methoxy-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]pyrazole-3-carbohydrazide Formula: C19H16BrN5O5 MolecularWeight: 474.26484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=NN(C=C2)CC3=CC(=CC=C3)Br)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=NN(C=C2)CC3=CC(=CC=C3)Br)C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrN5O5/c1-30-15-8-13(18(26)17(9-15)25(28)29)10-21-22-19(27)16-5-6-24(23-16)11-12-3-2-4-14(20)7-12/h2-10,21H,11H2,1H3,(H,22,27)