N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C18H14ClN5O6 MolecularWeight: 431.78666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C18H14ClN5O6/c1-10-16(24(28)29)17(22(2)21-10)18(25)20-12-7-13(23(26)27)9-15(8-12)30-14-5-3-11(19)4-6-14/h3-9H,1-2H3,(H,20,25)