2-azanyl-4-[5-[(4-chloranylphenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-[(4-chloranylphenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[5-[(4-chlorophenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[5-[(4-chlorophenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(4-chlorophenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[5-[(4-chlorophenoxy)methyl]-2,4-dimethyl-phenyl]-5-keto-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C32H27ClF3N3O2 MolecularWeight: 578.02389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC(=C4)C(F)(F)F)N)C#N)COC5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC(=C4)C(F)(F)F)N)C#N)COC5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C32H27ClF3N3O2/c1-18-13-19(2)25(14-20(18)17-41-24-11-9-22(33)10-12-24)29-26(16-37)31(38)39(27-7-4-8-28(40)30(27)29)23-6-3-5-21(15-23)32(34,35)36/h3,5-6,9-15,29H,4,7-8,17,38H2,1-2H3