N5-(5-bromanyl-2-methyl-phenyl)isoquinoline-5,8-diamine

Systemtic Name: N5-(5-bromanyl-2-methyl-phenyl)isoquinoline-5,8-diamine Openeye Name: N5-(5-bromo-2-methyl-phenyl)isoquinoline-5,8-diamine CAS Name: N5-(5-bromo-2-methylphenyl)isoquinoline-5,8-diamine IUPAC Name: 5-N-(5-bromo-2-methylphenyl)isoquinoline-5,8-diamine Traditional Name: (8-amino-5-isoquinolyl)-(5-bromo-2-methyl-phenyl)amine Formula: C16H14BrN3 MolecularWeight: 328.20646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)NC2=C3C=CN=CC3=C(C=C2)N

Isomeric SMILES

CC1=C(C=C(C=C1)Br)NC2=C3C=CN=CC3=C(C=C2)N

InChI

InChI=1S/C16H14BrN3/c1-10-2-3-11(17)8-16(10)20-15-5-4-14(18)13-9-19-7-6-12(13)15/h2-9,20H,18H2,1H3