3-(4-pyridin-3-ylbutyl)isoquinolin-1-amine

Systemtic Name: 3-(4-pyridin-3-ylbutyl)isoquinolin-1-amine Openeye Name: 3-[4-(3-pyridyl)butyl]isoquinolin-1-amine CAS Name: 3-[4-(3-pyridinyl)butyl]-1-isoquinolinamine IUPAC Name: 3-(4-pyridin-3-ylbutyl)isoquinolin-1-amine Traditional Name: [3-[4-(3-pyridyl)butyl]-1-isoquinolyl]amine Formula: C18H19N3 MolecularWeight: 277.36356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N=C2N)CCCCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N=C2N)CCCCC3=CN=CC=C3

InChI

InChI=1S/C18H19N3/c19-18-17-10-4-2-8-15(17)12-16(21-18)9-3-1-6-14-7-5-11-20-13-14/h2,4-5,7-8,10-13H,1,3,6,9H2,(H2,19,21)