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

Systemtic Name: 2-(5-methyl-3,4-dinitro-pyrazol-1-yl)-N-(1-phenylethyl)ethanamide Openeye Name: 2-(5-methyl-3,4-dinitro-pyrazol-1-yl)-N-(1-phenylethyl)acetamide CAS Name: 2-(5-methyl-3,4-dinitro-1-pyrazolyl)-N-(1-phenylethyl)acetamide IUPAC Name: 2-(5-methyl-3,4-dinitropyrazol-1-yl)-N-(1-phenylethyl)acetamide Traditional Name: 2-(5-methyl-3,4-dinitro-pyrazol-1-yl)-N-(1-phenylethyl)acetamide Formula: C14H15N5O5 MolecularWeight: 333.2994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O5/c1-9(11-6-4-3-5-7-11)15-12(20)8-17-10(2)13(18(21)22)14(16-17)19(23)24/h3-7,9H,8H2,1-2H3,(H,15,20)