5-tert-butyl-N-[(2-chloranyl-5-nitro-phenyl)methylideneamino]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[(2-chloranyl-5-nitro-phenyl)methylideneamino]-1H-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-N-[(2-chloro-5-nitro-phenyl)methyleneamino]-1H-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[(2-chloro-5-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide IUPAC Name: 5-tert-butyl-N-[(2-chloro-5-nitrophenyl)methylideneamino]-1H-pyrazole-3-carboxamide Traditional Name: 5-tert-butyl-N-[(2-chloro-5-nitro-benzylidene)amino]-1H-pyrazole-3-carboxamide Formula: C15H16ClN5O3 MolecularWeight: 349.77224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClN5O3/c1-15(2,3)13-7-12(18-19-13)14(22)20-17-8-9-6-10(21(23)24)4-5-11(9)16/h4-8H,1-3H3,(H,18,19)(H,20,22)