3-[5-[3-(4-bromophenyl)-2-oxidanylidene-propyl]pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[5-[3-(4-bromophenyl)-2-oxidanylidene-propyl]pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[5-[3-(4-bromophenyl)-2-oxo-propyl]pyrazol-1-yl]benzonitrile CAS Name: 3-[5-[3-(4-bromophenyl)-2-oxopropyl]-1-pyrazolyl]benzonitrile IUPAC Name: 3-[5-[3-(4-bromophenyl)-2-oxopropyl]pyrazol-1-yl]benzonitrile Traditional Name: 3-[5-[3-(4-bromophenyl)-2-keto-propyl]pyrazol-1-yl]benzonitrile Formula: C19H14BrN3O MolecularWeight: 380.23796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=CC=N2)CC(=O)CC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=CC=N2)CC(=O)CC3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C19H14BrN3O/c20-16-6-4-14(5-7-16)11-19(24)12-18-8-9-22-23(18)17-3-1-2-15(10-17)13-21/h1-10H,11-12H2