2-(1-adamantylamino)-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile

Systemtic Name: 2-(1-adamantylamino)-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile Openeye Name: 2-(1-adamantylamino)-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile CAS Name: 2-(1-adamantylamino)-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile IUPAC Name: 2-(1-adamantylamino)-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile Traditional Name: 2-(1-adamantylamino)-5-keto-7,7-dimethyl-6,8-dihydroquinoline-3-carbonitrile Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=N2)NC34CC5CC(C3)CC(C5)C4)C#N)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=N2)NC34CC5CC(C3)CC(C5)C4)C#N)C(=O)C1)C

InChI

InChI=1S/C22H27N3O/c1-21(2)10-18-17(19(26)11-21)6-16(12-23)20(24-18)25-22-7-13-3-14(8-22)5-15(4-13)9-22/h6,13-15H,3-5,7-11H2,1-2H3,(H,24,25)