1-methyl-5-phenyl-4-(phenylcarbonyl)pyrazole-3-carbonitrile

Systemtic Name: 1-methyl-5-phenyl-4-(phenylcarbonyl)pyrazole-3-carbonitrile Openeye Name: 4-benzoyl-1-methyl-5-phenyl-pyrazole-3-carbonitrile CAS Name: 4-benzoyl-1-methyl-5-phenyl-3-pyrazolecarbonitrile IUPAC Name: 4-benzoyl-1-methyl-5-phenylpyrazole-3-carbonitrile Traditional Name: 4-benzoyl-1-methyl-5-phenyl-pyrazole-3-carbonitrile Formula: C18H13N3O MolecularWeight: 287.31532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C#N)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=N1)C#N)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H13N3O/c1-21-17(13-8-4-2-5-9-13)16(15(12-19)20-21)18(22)14-10-6-3-7-11-14/h2-11H,1H3