1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(2-methyl-4-nitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(2-methyl-4-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(2-methyl-4-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(2-methyl-4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(2-methyl-4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(2-methyl-4-nitro-phenyl)pyrazole-3-carboxamide Formula: C18H14ClN5O6 MolecularWeight: 431.78666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN5O6/c1-11-8-12(23(26)27)2-4-15(11)20-18(25)16-6-7-22(21-16)10-30-17-5-3-13(24(28)29)9-14(17)19/h2-9H,10H2,1H3,(H,20,25)