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

Systemtic Name: 2-azanyl-1-[3,5-bis(chloranyl)phenyl]-4-[3-[(2-bromanylphenoxy)methyl]-2,5-dimethyl-phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[3-[(2-bromophenoxy)methyl]-2,5-dimethyl-phenyl]-1-(3,5-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[3-[(2-bromophenoxy)methyl]-2,5-dimethylphenyl]-1-(3,5-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(2-bromophenoxy)methyl]-2,5-dimethylphenyl]-1-(3,5-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[3-[(2-bromophenoxy)methyl]-2,5-dimethyl-phenyl]-1-(3,5-dichlorophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C31H26BrCl2N3O2 MolecularWeight: 623.36704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=CC(=C4)Cl)Cl)N)C#N)C)COC5=CC=CC=C5Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=CC(=C4)Cl)Cl)N)C#N)C)COC5=CC=CC=C5Br

InChI

InChI=1S/C31H26BrCl2N3O2/c1-17-10-19(16-39-28-9-4-3-6-25(28)32)18(2)23(11-17)29-24(15-35)31(36)37(22-13-20(33)12-21(34)14-22)26-7-5-8-27(38)30(26)29/h3-4,6,9-14,29H,5,7-8,16,36H2,1-2H3