2-[(1-chloranylisoquinolin-3-yl)-methyl-amino]-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[(1-chloranylisoquinolin-3-yl)-methyl-amino]-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[(1-chloro-3-isoquinolyl)-methyl-amino]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[(1-chloro-3-isoquinolinyl)-methylamino]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[(1-chloroisoquinolin-3-yl)-methylamino]-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[(1-chloro-3-isoquinolyl)-methyl-amino]-N-(2,5-dimethylphenyl)acetamide Formula: C20H20ClN3O MolecularWeight: 353.8453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C2=CC3=CC=CC=C3C(=N2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C2=CC3=CC=CC=C3C(=N2)Cl

InChI

InChI=1S/C20H20ClN3O/c1-13-8-9-14(2)17(10-13)22-19(25)12-24(3)18-11-15-6-4-5-7-16(15)20(21)23-18/h4-11H,12H2,1-3H3,(H,22,25)