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

Systemtic Name: 2-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-3-yl)-3-pyridin-4-yl-propanenitrile hydrochloride Openeye Name: 2-(7-methoxyspiro[3H-benzofuran-2,1'-cyclopentane]-3-yl)-3-(4-pyridyl)propanenitrile hydrochloride CAS Name: 2-(7-methoxy-3-spiro[3H-benzofuran-2,1'-cyclopentane]yl)-3-pyridin-4-ylpropanenitrile hydrochloride IUPAC Name: 2-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-3-yl)-3-pyridin-4-ylpropanenitrile hydrochloride Traditional Name: 2-(7-methoxyspiro[coumaran-2,1'-cyclopentane]-3-yl)-3-(4-pyridyl)propionitrile hydrochloride Formula: C21H23ClN2O2 MolecularWeight: 370.87252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3(C2C(CC4=CC=NC=C4)C#N)CCCC3.Cl

Isomeric SMILES

COC1=CC=CC2=C1OC3(C2C(CC4=CC=NC=C4)C#N)CCCC3.Cl

InChI

InChI=1S/C21H22N2O2.ClH/c1-24-18-6-4-5-17-19(21(25-20(17)18)9-2-3-10-21)16(14-22)13-15-7-11-23-12-8-15;/h4-8,11-12,16,19H,2-3,9-10,13H2,1H3;1H