2-azanyl-1-(4-fluorophenyl)-4-(3-methoxy-4-oxidanyl-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-fluorophenyl)-4-(3-methoxy-4-oxidanyl-phenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-fluorophenyl)-4-(4-hydroxy-3-methoxy-phenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-fluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-fluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-fluorophenyl)-4-(4-hydroxy-3-methoxy-phenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C25H24FN3O3 MolecularWeight: 433.474763

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)F)N)C#N)C4=CC(=C(C=C4)O)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC=C(C=C3)F)N)C#N)C4=CC(=C(C=C4)O)OC)C(=O)C1)C

InChI

InChI=1S/C25H24FN3O3/c1-25(2)11-18-23(20(31)12-25)22(14-4-9-19(30)21(10-14)32-3)17(13-27)24(28)29(18)16-7-5-15(26)6-8-16/h4-10,22,30H,11-12,28H2,1-3H3