2-azanyl-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(3-chlorophenyl)-4-(2,4-dimethylphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H26ClN3O MolecularWeight: 431.95714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=CC=C4)Cl)N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=CC=C4)Cl)N)C#N)C

InChI

InChI=1S/C26H26ClN3O/c1-15-8-9-19(16(2)10-15)23-20(14-28)25(29)30(18-7-5-6-17(27)11-18)21-12-26(3,4)13-22(31)24(21)23/h5-11,23H,12-13,29H2,1-4H3