4-[4-methanoyl-1-(2-methylpropyl)pyrazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-methanoyl-1-(2-methylpropyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-(4-formyl-1-isobutyl-pyrazol-3-yl)benzonitrile CAS Name: 4-[4-formyl-1-(2-methylpropyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[4-formyl-1-(2-methylpropyl)pyrazol-3-yl]benzonitrile Traditional Name: 4-(4-formyl-1-isobutyl-pyrazol-3-yl)benzonitrile Formula: C15H15N3O MolecularWeight: 253.2991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O/c1-11(2)8-18-9-14(10-19)15(17-18)13-5-3-12(7-16)4-6-13/h3-6,9-11H,8H2,1-2H3