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

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-nitropyrazol-1-yl)methyl]benzamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-nitropyrazol-1-yl)methyl]benzamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-[(4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-3-[(4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-3-[(4-nitropyrazol-1-yl)methyl]benzamide Formula: C24H18ClN5O6 MolecularWeight: 507.88262

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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=CC(=CC=C3)CN4C=C(C=N4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)CN4C=C(C=N4)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H18ClN5O6/c1-15-7-21(5-6-23(15)25)36-22-10-18(9-19(11-22)29(32)33)27-24(31)17-4-2-3-16(8-17)13-28-14-20(12-26-28)30(34)35/h2-12,14H,13H2,1H3,(H,27,31)