2-azanyl-1-(5-chloranyl-2-methyl-phenyl)-4-(2,4-dimethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(5-chloranyl-2-methyl-phenyl)-4-(2,4-dimethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(5-chloro-2-methyl-phenyl)-4-(2,4-dimethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(5-chloro-2-methylphenyl)-4-(2,4-dimethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(5-chloro-2-methylphenyl)-4-(2,4-dimethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(5-chloro-2-methyl-phenyl)-4-(2,4-dimethylphenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H24ClN3O MolecularWeight: 417.93056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)Cl)C)N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC(=C4)Cl)C)N)C#N)C

InChI

InChI=1S/C25H24ClN3O/c1-14-7-10-18(16(3)11-14)23-19(13-27)25(28)29(20-5-4-6-22(30)24(20)23)21-12-17(26)9-8-15(21)2/h7-12,23H,4-6,28H2,1-3H3