N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[(E)-1-(4-chlorophenyl)ethylideneamino]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C13H12ClN5O3 MolecularWeight: 321.71908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1[N+](=O)[O-])C)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN5O3/c1-8(9-3-5-10(14)6-4-9)15-16-13(20)12-11(19(21)22)7-18(2)17-12/h3-7H,1-2H3,(H,16,20)/b15-8+