2-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-fluorophenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-fluorophenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H17BrFN3 MolecularWeight: 422.292883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=C(C=C4)F)Br

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=C(C=C4)F)Br

InChI

InChI=1S/C22H17BrFN3/c23-18-11-15(6-8-19(18)24)21-16-10-14(13-4-2-1-3-5-13)7-9-20(16)27-22(26)17(21)12-25/h1-6,8,11,14H,7,9-10H2,(H2,26,27)