N-[3-(4-chloranyl-2-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[3-(4-chloranyl-2-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[3-(4-chloro-2-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[3-(4-chloro-2-methylphenoxy)-5-nitrophenyl]-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(4-chloro-2-methylphenoxy)-5-nitrophenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(4-chloro-2-methyl-phenoxy)-5-nitro-phenyl]-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C20H18ClN5O6 MolecularWeight: 459.83982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C(C)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN5O6/c1-12-5-14(21)3-4-19(12)32-18-7-15(6-16(8-18)25(28)29)23-20(27)13(2)10-24-11-17(9-22-24)26(30)31/h3-9,11,13H,10H2,1-2H3,(H,23,27)