N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propanamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(5-methyl-3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(5-methyl-3-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-(5-methyl-3-nitro-pyrazol-1-yl)propionamide Formula: C19H16ClN5O6 MolecularWeight: 445.81324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H16ClN5O6/c1-12-8-18(25(29)30)22-23(12)7-6-19(26)21-14-9-15(24(27)28)11-17(10-14)31-16-4-2-13(20)3-5-16/h2-5,8-11H,6-7H2,1H3,(H,21,26)