N'-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(4-methylphenyl)adamantane-1-carbohydrazide

Systemtic Name: N'-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(4-methylphenyl)adamantane-1-carbohydrazide Openeye Name: N'-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(p-tolyl)adamantane-1-carbohydrazide CAS Name: N'-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-(4-methylphenyl)-1-adamantanecarbohydrazide IUPAC Name: N'-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-(4-methylphenyl)adamantane-1-carbohydrazide Traditional Name: N'-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-3-(p-tolyl)adamantane-1-carbohydrazide Formula: C25H26BrN3O4 MolecularWeight: 512.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NNC=C5C=C(C=C(C5=O)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NNC=C5C=C(C=C(C5=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C25H26BrN3O4/c1-15-2-4-19(5-3-15)24-9-16-6-17(10-24)12-25(11-16,14-24)23(31)28-27-13-18-7-20(29(32)33)8-21(26)22(18)30/h2-5,7-8,13,16-17,27H,6,9-12,14H2,1H3,(H,28,31)