1,5-diphenyl-3-(pyridin-3-ylmethyl)pentane-1,5-dione hydrobromide

Systemtic Name: 1,5-diphenyl-3-(pyridin-3-ylmethyl)pentane-1,5-dione hydrobromide Openeye Name: 1,5-diphenyl-3-(3-pyridylmethyl)pentane-1,5-dione hydrobromide CAS Name: 1,5-diphenyl-3-(3-pyridinylmethyl)pentane-1,5-dione hydrobromide IUPAC Name: 1,5-diphenyl-3-(pyridin-3-ylmethyl)pentane-1,5-dione hydrobromide Traditional Name: 1,5-diphenyl-3-(3-pyridylmethyl)pentane-1,5-dione hydrobromide Formula: C23H22BrNO2 MolecularWeight: 424.33028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(CC2=CN=CC=C2)CC(=O)C3=CC=CC=C3.Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(CC2=CN=CC=C2)CC(=O)C3=CC=CC=C3.Br

InChI

InChI=1S/C23H21NO2.BrH/c25-22(20-9-3-1-4-10-20)15-19(14-18-8-7-13-24-17-18)16-23(26)21-11-5-2-6-12-21;/h1-13,17,19H,14-16H2;1H