2-bromanyl-1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-pyridin-4-yl-ethanone hydrobromide

Systemtic Name: 2-bromanyl-1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-pyridin-4-yl-ethanone hydrobromide Openeye Name: 2-bromo-1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethanone hydrobromide CAS Name: 2-bromo-1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethanone hydrobromide IUPAC Name: 2-bromo-1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethanone hydrobromide Traditional Name: 2-bromo-1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethanone hydrobromide Formula: C19H21Br2NO3 MolecularWeight: 471.18294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(C2=CC=NC=C2)Br)OC3CCCC3.Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C(C2=CC=NC=C2)Br)OC3CCCC3.Br

InChI

InChI=1S/C19H20BrNO3.BrH/c1-23-16-7-6-14(12-17(16)24-15-4-2-3-5-15)19(22)18(20)13-8-10-21-11-9-13;/h6-12,15,18H,2-5H2,1H3;1H