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

Systemtic Name: 2-azanyl-1-(5-chloranyl-2-methyl-phenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(5-chloro-2-methyl-phenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(5-chloro-2-methylphenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(5-chloro-2-methylphenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(5-chloro-2-methyl-phenyl)-4-[2,5-dimethyl-3-[(4-methylphenoxy)methyl]phenyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C33H32ClN3O2 MolecularWeight: 538.07908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C(C(=CC(=C2)C)C3C(=C(N(C4=C3C(=O)CCC4)C5=C(C=CC(=C5)Cl)C)N)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C(C(=CC(=C2)C)C3C(=C(N(C4=C3C(=O)CCC4)C5=C(C=CC(=C5)Cl)C)N)C#N)C

InChI

InChI=1S/C33H32ClN3O2/c1-19-8-12-25(13-9-19)39-18-23-14-20(2)15-26(22(23)4)31-27(17-35)33(36)37(28-6-5-7-30(38)32(28)31)29-16-24(34)11-10-21(29)3/h8-16,31H,5-7,18,36H2,1-4H3