N-[(2-aminophenyl)methyl]-N-piperidin-3-yl-isoquinolin-5-amine

Systemtic Name: N-[(2-aminophenyl)methyl]-N-piperidin-3-yl-isoquinolin-5-amine Openeye Name: N-[(2-aminophenyl)methyl]-N-(3-piperidyl)isoquinolin-5-amine CAS Name: N-[(2-aminophenyl)methyl]-N-(3-piperidinyl)-5-isoquinolinamine IUPAC Name: N-[(2-aminophenyl)methyl]-N-piperidin-3-ylisoquinolin-5-amine Traditional Name: (2-aminobenzyl)-(5-isoquinolyl)-(3-piperidyl)amine Formula: C21H24N4 MolecularWeight: 332.44206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N(CC2=CC=CC=C2N)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CC(CNC1)N(CC2=CC=CC=C2N)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H24N4/c22-20-8-2-1-5-17(20)15-25(18-7-4-11-23-14-18)21-9-3-6-16-13-24-12-10-19(16)21/h1-3,5-6,8-10,12-13,18,23H,4,7,11,14-15,22H2