N-(4-methyl-3,5-dinitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-3-(4-nitropyrazol-1-yl)propionamide Formula: C13H12N6O7 MolecularWeight: 364.27038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)CCN2C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O7/c1-8-11(18(23)24)4-9(5-12(8)19(25)26)15-13(20)2-3-16-7-10(6-14-16)17(21)22/h4-7H,2-3H2,1H3,(H,15,20)