(8aS,10aS)-6,7-dimethyl-9-oxidanylidene-8,10a-dihydro-5H-xanthene-8a-carbonitrile

Systemtic Name: (8aS,10aS)-6,7-dimethyl-9-oxidanylidene-8,10a-dihydro-5H-xanthene-8a-carbonitrile Openeye Name: (8aS,10aS)-6,7-dimethyl-9-oxo-8,10a-dihydro-5H-xanthene-8a-carbonitrile CAS Name: (8aS,10aS)-6,7-dimethyl-9-oxo-8,10a-dihydro-5H-xanthene-8a-carbonitrile IUPAC Name: (8aS,10aS)-6,7-dimethyl-9-oxo-8,10a-dihydro-5H-xanthene-8a-carbonitrile Traditional Name: (8aS,10aS)-9-keto-6,7-dimethyl-8,10a-dihydro-5H-xanthene-8a-carbonitrile Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2(C(C1)OC3=CC=CC=C3C2=O)C#N)C

Isomeric SMILES

CC1=C(C[C@@]2([C@H](C1)OC3=CC=CC=C3C2=O)C#N)C

InChI

InChI=1S/C16H15NO2/c1-10-7-14-16(9-17,8-11(10)2)15(18)12-5-3-4-6-13(12)19-14/h3-6,14H,7-8H2,1-2H3/t14-,16-/m0/s1