1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclohexane]-4-yl)-2-pyridin-4-yl-ethanone hydrochloride

Systemtic Name: 1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclohexane]-4-yl)-2-pyridin-4-yl-ethanone hydrochloride Openeye Name: 1-(7-methoxyspiro[3H-benzofuran-2,1'-cyclohexane]-4-yl)-2-(4-pyridyl)ethanone hydrochloride CAS Name: 1-(7-methoxy-4-spiro[3H-benzofuran-2,1'-cyclohexane]yl)-2-pyridin-4-ylethanone hydrochloride IUPAC Name: 1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclohexane]-4-yl)-2-pyridin-4-ylethanone hydrochloride Traditional Name: 1-(7-methoxyspiro[coumaran-2,1'-cyclohexane]-4-yl)-2-(4-pyridyl)ethanone hydrochloride Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)CC3=CC=NC=C3)CC4(O2)CCCCC4.Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)CC3=CC=NC=C3)CC4(O2)CCCCC4.Cl

InChI

InChI=1S/C21H23NO3.ClH/c1-24-19-6-5-16(18(23)13-15-7-11-22-12-8-15)17-14-21(25-20(17)19)9-3-2-4-10-21;/h5-8,11-12H,2-4,9-10,13-14H2,1H3;1H