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

Systemtic Name: 2-azanyl-4-(4-bromanyl-2-fluoranyl-phenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-2-fluoro-phenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-2-fluorophenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-2-fluorophenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-2-fluoro-phenyl)-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C17H15BrFN3 MolecularWeight: 360.223503

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1CCC2=C(C1)C(=C(C(=N2)N)C#N)C3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H15BrFN3/c1-9-2-5-15-12(6-9)16(13(8-20)17(21)22-15)11-4-3-10(18)7-14(11)19/h3-4,7,9H,2,5-6H2,1H3,(H2,21,22)