5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide

Systemtic Name: 5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Openeye Name: 5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide CAS Name: 5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1H-pyrazole-3-carbohydrazide IUPAC Name: 5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Traditional Name: 5-(1-adamantyl)-N'-[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNNC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CNNC(=O)C2=NNC(=C2)C34CC5CC(C3)CC(C5)C4)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C29H40N4O2/c1-27(2,3)21-10-20(11-22(25(21)34)28(4,5)6)16-30-33-26(35)23-12-24(32-31-23)29-13-17-7-18(14-29)9-19(8-17)15-29/h10-12,16-19,30H,7-9,13-15H2,1-6H3,(H,31,32)(H,33,35)