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

Systemtic Name: 5-tert-butyl-N'-[(3-methoxy-2-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Openeye Name: 5-tert-butyl-N'-[(3-methoxy-2-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide CAS Name: 5-tert-butyl-N'-[(3-methoxy-2-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-1H-pyrazole-3-carbohydrazide IUPAC Name: 5-tert-butyl-N'-[(3-methoxy-2-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Traditional Name: 5-tert-butyl-N'-[(4-keto-3-methoxy-2-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]-1H-pyrazole-3-carbohydrazide Formula: C16H19N5O5 MolecularWeight: 361.35256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NNC=C2C=CC(=O)C(=C2[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)NNC=C2C=CC(=O)C(=C2[N+](=O)[O-])OC

InChI

InChI=1S/C16H19N5O5/c1-16(2,3)12-7-10(18-19-12)15(23)20-17-8-9-5-6-11(22)14(26-4)13(9)21(24)25/h5-8,17H,1-4H3,(H,18,19)(H,20,23)