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

Systemtic Name: 2-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-4-yl)-2-methyl-3-pyridin-4-yl-propanenitrile hydrochloride Openeye Name: 2-(7-methoxyspiro[3H-benzofuran-2,1'-cyclopentane]-4-yl)-2-methyl-3-(4-pyridyl)propanenitrile hydrochloride CAS Name: 2-(7-methoxy-4-spiro[3H-benzofuran-2,1'-cyclopentane]yl)-2-methyl-3-pyridin-4-ylpropanenitrile hydrochloride IUPAC Name: 2-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-4-yl)-2-methyl-3-pyridin-4-ylpropanenitrile hydrochloride Traditional Name: 2-(7-methoxyspiro[coumaran-2,1'-cyclopentane]-4-yl)-2-methyl-3-(4-pyridyl)propionitrile hydrochloride Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=NC=C1)(C#N)C2=C3CC4(CCCC4)OC3=C(C=C2)OC.Cl

Isomeric SMILES

CC(CC1=CC=NC=C1)(C#N)C2=C3CC4(CCCC4)OC3=C(C=C2)OC.Cl

InChI

InChI=1S/C22H24N2O2.ClH/c1-21(15-23,13-16-7-11-24-12-8-16)18-5-6-19(25-2)20-17(18)14-22(26-20)9-3-4-10-22;/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3;1H