N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propanamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-methylpropanamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-methylpropanamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-methyl-propionamide Formula: C21H20ClN5O6 MolecularWeight: 473.8664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN5O6/c1-12(11-25-14(3)20(27(31)32)13(2)24-25)21(28)23-16-8-17(26(29)30)10-19(9-16)33-18-6-4-15(22)5-7-18/h4-10,12H,11H2,1-3H3,(H,23,28)