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

Systemtic Name: 2-azanyl-4-[5-[(2-bromanylphenoxy)methyl]-2,4-dimethyl-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[5-[(2-bromophenoxy)methyl]-2,4-dimethyl-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[5-[(2-bromophenoxy)methyl]-2,4-dimethyl-phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H24BrN3O MolecularWeight: 462.38156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=CC=CC=C4Br)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=CC=CC=C4Br)C

InChI

InChI=1S/C25H24BrN3O/c1-15-11-16(2)19(12-17(15)14-30-23-10-6-4-8-21(23)26)24-18-7-3-5-9-22(18)29-25(28)20(24)13-27/h4,6,8,10-12H,3,5,7,9,14H2,1-2H3,(H2,28,29)