N-(2-chloranyl-5-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-chloro-5-nitrophenyl)-1-[(2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-1-[(2-nitrophenoxy)methyl]pyrazole-3-carboxamide Formula: C17H12ClN5O6 MolecularWeight: 417.76008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OCN2C=CC(=N2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN5O6/c18-12-6-5-11(22(25)26)9-14(12)19-17(24)13-7-8-21(20-13)10-29-16-4-2-1-3-15(16)23(27)28/h1-9H,10H2,(H,19,24)