5-methyl-3-nitro-1-phenacyl-pyrazole-4-carbonitrile

Systemtic Name: 5-methyl-3-nitro-1-phenacyl-pyrazole-4-carbonitrile Openeye Name: 5-methyl-3-nitro-1-phenacyl-pyrazole-4-carbonitrile CAS Name: 5-methyl-3-nitro-1-phenacyl-4-pyrazolecarbonitrile IUPAC Name: 5-methyl-3-nitro-1-phenacylpyrazole-4-carbonitrile Traditional Name: 5-methyl-3-nitro-1-phenacyl-pyrazole-4-carbonitrile Formula: C13H10N4O3 MolecularWeight: 270.2435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O3/c1-9-11(7-14)13(17(19)20)15-16(9)8-12(18)10-5-3-2-4-6-10/h2-6H,8H2,1H3