N-(3-bromanyl-4-methyl-phenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine

Systemtic Name: N-(3-bromanyl-4-methyl-phenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine Openeye Name: N-(3-bromo-4-methyl-phenyl)-4-[2-(3-pyridyl)ethyl]isoquinolin-1-amine CAS Name: N-(3-bromo-4-methylphenyl)-4-[2-(3-pyridinyl)ethyl]-1-isoquinolinamine IUPAC Name: N-(3-bromo-4-methylphenyl)-4-(2-pyridin-3-ylethyl)isoquinolin-1-amine Traditional Name: (3-bromo-4-methyl-phenyl)-[4-[2-(3-pyridyl)ethyl]-1-isoquinolyl]amine Formula: C23H20BrN3 MolecularWeight: 418.329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=CC=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C3=CC=CC=C32)CCC4=CN=CC=C4)Br

InChI

InChI=1S/C23H20BrN3/c1-16-8-11-19(13-22(16)24)27-23-21-7-3-2-6-20(21)18(15-26-23)10-9-17-5-4-12-25-14-17/h2-8,11-15H,9-10H2,1H3,(H,26,27)