5,6-dimethoxy-3-oxidanylidene-1,2-dihydroindene-2-carbonitrile

Systemtic Name: 5,6-dimethoxy-3-oxidanylidene-1,2-dihydroindene-2-carbonitrile Openeye Name: 5,6-dimethoxy-1-oxo-indane-2-carbonitrile CAS Name: 5,6-dimethoxy-3-oxo-1,2-dihydroindene-2-carbonitrile IUPAC Name: 5,6-dimethoxy-3-oxo-1,2-dihydroindene-2-carbonitrile Traditional Name: 1-keto-5,6-dimethoxy-indane-2-carbonitrile Formula: C12H11NO3 MolecularWeight: 217.22064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)C#N)OC

InChI

InChI=1S/C12H11NO3/c1-15-10-4-7-3-8(6-13)12(14)9(7)5-11(10)16-2/h4-5,8H,3H2,1-2H3