N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C18H14ClN5O7 MolecularWeight: 447.78606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H14ClN5O7/c1-9-5-12(3-4-14(9)19)31-13-7-10(6-11(8-13)23(26)27)20-17(25)15-16(24(28)29)18(30-2)22-21-15/h3-8H,1-2H3,(H,20,25)(H,21,22)