1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-4-yl)-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: 1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-4-yl)-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: 1-(7-methoxyspiro[3H-benzofuran-2,1'-cyclopentane]-4-yl)-4-oxo-cyclohexanecarbonitrile CAS Name: 1-(7-methoxy-4-spiro[3H-benzofuran-2,1'-cyclopentane]yl)-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: 1-(7-methoxyspiro[3H-1-benzofuran-2,1'-cyclopentane]-4-yl)-4-oxocyclohexane-1-carbonitrile Traditional Name: 4-keto-1-(7-methoxyspiro[coumaran-2,1'-cyclopentane]-4-yl)cyclohexanecarbonitrile Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3(CCC(=O)CC3)C#N)CC4(O2)CCCC4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3(CCC(=O)CC3)C#N)CC4(O2)CCCC4

InChI

InChI=1S/C20H23NO3/c1-23-17-5-4-16(19(13-21)10-6-14(22)7-11-19)15-12-20(24-18(15)17)8-2-3-9-20/h4-5H,2-3,6-12H2,1H3