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

Systemtic Name: 2-azanyl-4-[5-[(4-chloranyl-2-methyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxidanylidene-1-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[5-[(4-chloro-2-methyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-oxo-1-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl]-5-oxo-1-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[5-[(4-chloro-2-methyl-phenoxy)methyl]-2,4-dimethyl-phenyl]-5-keto-1-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C33H29ClF3N3O2 MolecularWeight: 592.05047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H29ClF3N3O2/c1-18-13-19(2)25(15-21(18)17-42-29-12-9-23(34)14-20(29)3)30-26(16-38)32(39)40(27-5-4-6-28(41)31(27)30)24-10-7-22(8-11-24)33(35,36)37/h7-15,30H,4-6,17,39H2,1-3H3