3-[5-[2-(4-bromophenyl)ethanoyl]-3-methyl-pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[5-[2-(4-bromophenyl)ethanoyl]-3-methyl-pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[5-[2-(4-bromophenyl)acetyl]-3-methyl-pyrazol-1-yl]benzonitrile CAS Name: 3-[5-[2-(4-bromophenyl)-1-oxoethyl]-3-methyl-1-pyrazolyl]benzonitrile IUPAC Name: 3-[5-[2-(4-bromophenyl)acetyl]-3-methylpyrazol-1-yl]benzonitrile Traditional Name: 3-[5-[2-(4-bromophenyl)acetyl]-3-methyl-pyrazol-1-yl]benzonitrile Formula: C19H14BrN3O MolecularWeight: 380.23796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)CC2=CC=C(C=C2)Br)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)CC2=CC=C(C=C2)Br)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H14BrN3O/c1-13-9-18(19(24)11-14-5-7-16(20)8-6-14)23(22-13)17-4-2-3-15(10-17)12-21/h2-10H,11H2,1H3