2-(4-chloranyl-3-methyl-phenoxy)-N-isoquinolin-5-yl-ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-isoquinolin-5-yl-ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-(5-isoquinolyl)acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-(5-isoquinolinyl)acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-isoquinolin-5-ylacetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-(5-isoquinolyl)acetamide Formula: C18H15ClN2O2 MolecularWeight: 326.7769

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC3=C2C=CN=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC3=C2C=CN=C3)Cl

InChI

InChI=1S/C18H15ClN2O2/c1-12-9-14(5-6-16(12)19)23-11-18(22)21-17-4-2-3-13-10-20-8-7-15(13)17/h2-10H,11H2,1H3,(H,21,22)