N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide Openeye Name: N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitro-1-pyrazolyl)acetamide IUPAC Name: N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-(3-hydroxyphenyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C12H11N5O6 MolecularWeight: 321.24564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N5O6/c1-7-11(16(20)21)12(17(22)23)14-15(7)6-10(19)13-8-3-2-4-9(18)5-8/h2-5,18H,6H2,1H3,(H,13,19)