N-(cyanomethyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-phenyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-phenyl-acetamide Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N5O3/c1-11-15(20(22)23)12(2)19(17-11)10-14(21)18(9-8-16)13-6-4-3-5-7-13/h3-7H,9-10H2,1-2H3