3-[2-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)-5H-1,2-oxazol-5-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)-5H-1,2-oxazol-5-yl]benzenecarbonitrile Openeye Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)-5H-isoxazol-5-yl]benzonitrile CAS Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)-5H-isoxazol-5-yl]benzonitrile IUPAC Name: 3-[2-(7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)-5H-1,2-oxazol-5-yl]benzonitrile Traditional Name: 3-[2-(5-keto-7,7-dimethyl-6,8-dihydroquinolin-2-yl)-3-isoxazolin-5-yl]benzonitrile Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=N2)N3C=CC(O3)C4=CC=CC(=C4)C#N)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=CC(=N2)N3C=CC(O3)C4=CC=CC(=C4)C#N)C(=O)C1)C

InChI

InChI=1S/C21H19N3O2/c1-21(2)11-17-16(18(25)12-21)6-7-20(23-17)24-9-8-19(26-24)15-5-3-4-14(10-15)13-22/h3-10,19H,11-12H2,1-2H3