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

Systemtic Name: 2-(5-methyl-3,4-dinitro-pyrazol-1-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: 2-(5-methyl-3,4-dinitro-1-pyrazolyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-benzyl-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C13H13N5O5 MolecularWeight: 319.27282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCC2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCC2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5/c1-9-12(17(20)21)13(18(22)23)15-16(9)8-11(19)14-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,14,19)