2-octyl-3-oxidanylidene-1,2-dihydroindene-5-carbonitrile

Systemtic Name: 2-octyl-3-oxidanylidene-1,2-dihydroindene-5-carbonitrile Openeye Name: 2-octyl-3-oxo-indane-5-carbonitrile CAS Name: 2-octyl-3-oxo-1,2-dihydroindene-5-carbonitrile IUPAC Name: 2-octyl-3-oxo-1,2-dihydroindene-5-carbonitrile Traditional Name: 3-keto-2-octyl-indane-5-carbonitrile Formula: C18H23NO MolecularWeight: 269.38132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CC2=C(C1=O)C=C(C=C2)C#N

Isomeric SMILES

CCCCCCCCC1CC2=C(C1=O)C=C(C=C2)C#N

InChI

InChI=1S/C18H23NO/c1-2-3-4-5-6-7-8-16-12-15-10-9-14(13-19)11-17(15)18(16)20/h9-11,16H,2-8,12H2,1H3