3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonitrile CAS Name: 3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazole-4-carbonitrile Traditional Name: 3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazole-4-carbonitrile Formula: C17H12N4O3 MolecularWeight: 320.30218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C#N)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O3/c1-24-16-8-7-12(9-15(16)21(22)23)17-13(10-18)11-20(19-17)14-5-3-2-4-6-14/h2-9,11H,1H3