N'-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(3-methoxy-4-phenylmethoxy-phenyl)-1H-pyrazole-5-carbohydrazide

Systemtic Name: N'-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(3-methoxy-4-phenylmethoxy-phenyl)-1H-pyrazole-5-carbohydrazide Openeye Name: 3-(4-benzyloxy-3-methoxy-phenyl)-N'-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide CAS Name: N'-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-(3-methoxy-4-phenylmethoxyphenyl)-1H-pyrazole-5-carbohydrazide IUPAC Name: N'-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-(3-methoxy-4-phenylmethoxyphenyl)-1H-pyrazole-5-carbohydrazide Traditional Name: 3-(4-benzoxy-3-methoxy-phenyl)-N'-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazole-5-carbohydrazide Formula: C25H21BrN4O4 MolecularWeight: 521.36264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NNC(=C2)C(=O)NNC=C3C=C(C=CC3=O)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NNC(=C2)C(=O)NNC=C3C=C(C=CC3=O)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21BrN4O4/c1-33-24-12-17(7-10-23(24)34-15-16-5-3-2-4-6-16)20-13-21(29-28-20)25(32)30-27-14-18-11-19(26)8-9-22(18)31/h2-14,27H,15H2,1H3,(H,28,29)(H,30,32)