N-(3-chloranyl-4-propan-2-yloxy-phenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-4-isopropoxy-phenyl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-4-propan-2-yloxyphenyl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-4-propan-2-yloxyphenyl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-4-isopropoxy-phenyl)acetamide Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C)Cl

InChI

InChI=1S/C22H23ClN2O3/c1-14(2)28-21-9-8-17(12-19(21)23)24-22(27)13-20-18-7-5-4-6-16(18)10-11-25(20)15(3)26/h4-12,14,20H,13H2,1-3H3,(H,24,27)