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

Systemtic Name: 2-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-4-[3-[(4-methoxyphenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-chloro-4-fluoro-phenyl)-4-[3-[(4-methoxyphenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(3-chloro-4-fluorophenyl)-4-[3-[(4-methoxyphenoxy)methyl]-2,5-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-chloro-4-fluorophenyl)-4-[3-[(4-methoxyphenoxy)methyl]-2,5-dimethylphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(3-chloro-4-fluoro-phenyl)-5-keto-4-[3-[(4-methoxyphenoxy)methyl]-2,5-dimethyl-phenyl]-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C34H33ClFN3O3 MolecularWeight: 586.095523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=C(C=C4)F)Cl)N)C#N)C)COC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=C(C(=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=C(C=C4)F)Cl)N)C#N)C)COC5=CC=C(C=C5)OC

InChI

InChI=1S/C34H33ClFN3O3/c1-19-12-21(18-42-24-9-7-23(41-5)8-10-24)20(2)25(13-19)31-26(17-37)33(38)39(22-6-11-28(36)27(35)14-22)29-15-34(3,4)16-30(40)32(29)31/h6-14,31H,15-16,18,38H2,1-5H3