2-[(3-fluorophenyl)methylamino]-N-isoquinolin-6-yl-ethanamide

Systemtic Name: 2-[(3-fluorophenyl)methylamino]-N-isoquinolin-6-yl-ethanamide Openeye Name: 2-[(3-fluorophenyl)methylamino]-N-(6-isoquinolyl)acetamide CAS Name: 2-[(3-fluorophenyl)methylamino]-N-(6-isoquinolinyl)acetamide IUPAC Name: 2-[(3-fluorophenyl)methylamino]-N-isoquinolin-6-ylacetamide Traditional Name: 2-[(3-fluorobenzyl)amino]-N-(6-isoquinolyl)acetamide Formula: C18H16FN3O MolecularWeight: 309.337543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNCC(=O)NC2=CC3=C(C=C2)C=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)F)CNCC(=O)NC2=CC3=C(C=C2)C=NC=C3

InChI

InChI=1S/C18H16FN3O/c19-16-3-1-2-13(8-16)10-21-12-18(23)22-17-5-4-15-11-20-7-6-14(15)9-17/h1-9,11,21H,10,12H2,(H,22,23)