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

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-fluorophenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-fluorophenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-fluoro-phenyl)-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C18H17BrFN3 MolecularWeight: 374.250083

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)F)Br

Isomeric SMILES

CCC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C18H17BrFN3/c1-2-10-3-6-16-12(7-10)17(13(9-21)18(22)23-16)11-4-5-15(20)14(19)8-11/h4-5,8,10H,2-3,6-7H2,1H3,(H2,22,23)