1-[7-methoxy-2-(2-propan-2-ylphenyl)-1-benzofuran-4-yl]-2-pyridin-4-yl-ethanone hydrochloride

Systemtic Name: 1-[7-methoxy-2-(2-propan-2-ylphenyl)-1-benzofuran-4-yl]-2-pyridin-4-yl-ethanone hydrochloride Openeye Name: 1-[2-(2-isopropylphenyl)-7-methoxy-benzofuran-4-yl]-2-(4-pyridyl)ethanone hydrochloride CAS Name: 1-[7-methoxy-2-(2-propan-2-ylphenyl)-4-benzofuranyl]-2-pyridin-4-ylethanone hydrochloride IUPAC Name: 1-[7-methoxy-2-(2-propan-2-ylphenyl)-1-benzofuran-4-yl]-2-pyridin-4-ylethanone hydrochloride Traditional Name: 1-(7-methoxy-2-o-cumenyl-benzofuran-4-yl)-2-(4-pyridyl)ethanone hydrochloride Formula: C25H24ClNO3 MolecularWeight: 421.91596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1C2=CC3=C(C=CC(=C3O2)OC)C(=O)CC4=CC=NC=C4.Cl

Isomeric SMILES

CC(C)C1=CC=CC=C1C2=CC3=C(C=CC(=C3O2)OC)C(=O)CC4=CC=NC=C4.Cl

InChI

InChI=1S/C25H23NO3.ClH/c1-16(2)18-6-4-5-7-20(18)24-15-21-19(8-9-23(28-3)25(21)29-24)22(27)14-17-10-12-26-13-11-17;/h4-13,15-16H,14H2,1-3H3;1H