N-(3-chloranyl-4-methoxy-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H13ClN4O4 MolecularWeight: 324.71972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN4O4/c1-7-11(18(20)21)12(17(2)16-7)13(19)15-8-4-5-10(22-3)9(14)6-8/h4-6H,1-3H3,(H,15,19)