N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-4-bromanyl-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3-[2,4-bis(chloranyl)phenoxy]-5-nitro-phenyl]-4-bromanyl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-[3-(2,4-dichlorophenoxy)-5-nitro-phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C16H8BrCl2N5O6 MolecularWeight: 517.07462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H8BrCl2N5O6/c17-13-14(21-22-15(13)24(28)29)16(25)20-8-4-9(23(26)27)6-10(5-8)30-12-2-1-7(18)3-11(12)19/h1-6H,(H,20,25)(H,21,22)