N-(4-chloranyl-2-nitro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C16H14ClN7O5 MolecularWeight: 419.77926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN7O5/c1-9-15(24(28)29)10(2)22(19-9)8-21-6-5-13(20-21)16(25)18-12-4-3-11(17)7-14(12)23(26)27/h3-7H,8H2,1-2H3,(H,18,25)