5-tert-butyl-N-[(E)-(2-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[(E)-(2-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-N-[(E)-(2-nitrophenyl)methyleneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[(E)-(2-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-tert-butyl-N-[(E)-(2-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-N-[(E)-(2-nitrobenzylidene)amino]-1H-pyrazole-3-carboxamide Formula: C15H17N5O3 MolecularWeight: 315.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O3/c1-15(2,3)13-8-11(17-18-13)14(21)19-16-9-10-6-4-5-7-12(10)20(22)23/h4-9H,1-3H3,(H,17,18)(H,19,21)/b16-9+