2-azanyl-4-[3-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-1-(2-methylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-[(2-chloranyl-4-fluoranyl-phenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-1-(2-methylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-[3-[(2-chloro-4-fluoro-phenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-1-(o-tolyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[3-[(2-chloro-4-fluorophenoxy)methyl]-2,5-dimethylphenyl]-7,7-dimethyl-1-(2-methylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(2-chloro-4-fluorophenoxy)methyl]-2,5-dimethylphenyl]-7,7-dimethyl-1-(2-methylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[3-[(2-chloro-4-fluoro-phenoxy)methyl]-2,5-dimethyl-phenyl]-5-keto-7,7-dimethyl-1-(o-tolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C34H33ClFN3O2 MolecularWeight: 570.096123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C(C(=C2N)C#N)C4=CC(=CC(=C4C)COC5=C(C=C(C=C5)F)Cl)C)C(=O)CC(C3)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C(C(=C2N)C#N)C4=CC(=CC(=C4C)COC5=C(C=C(C=C5)F)Cl)C)C(=O)CC(C3)(C)C

InChI

InChI=1S/C34H33ClFN3O2/c1-19-12-22(18-41-30-11-10-23(36)14-26(30)35)21(3)24(13-19)31-25(17-37)33(38)39(27-9-7-6-8-20(27)2)28-15-34(4,5)16-29(40)32(28)31/h6-14,31H,15-16,18,38H2,1-5H3