N-[2-(4-methoxyphenyl)-5-methyl-pyrazol-3-yl]-2,6-dinitro-benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)-5-methyl-pyrazol-3-yl]-2,6-dinitro-benzamide Openeye Name: N-[2-(4-methoxyphenyl)-5-methyl-pyrazol-3-yl]-2,6-dinitro-benzamide CAS Name: N-[2-(4-methoxyphenyl)-5-methyl-3-pyrazolyl]-2,6-dinitrobenzamide IUPAC Name: N-[2-(4-methoxyphenyl)-5-methylpyrazol-3-yl]-2,6-dinitrobenzamide Traditional Name: N-[2-(4-methoxyphenyl)-5-methyl-pyrazol-3-yl]-2,6-dinitro-benzamide Formula: C18H15N5O6 MolecularWeight: 397.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H15N5O6/c1-11-10-16(21(20-11)12-6-8-13(29-2)9-7-12)19-18(24)17-14(22(25)26)4-3-5-15(17)23(27)28/h3-10H,1-2H3,(H,19,24)