N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6-chloro-1,3-benzodioxol-5-yl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6-chloro-1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6-chloro-1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(6-chloro-1,3-benzodioxol-5-yl)acetamide Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C20H17ClN2O4/c1-12(24)23-7-6-13-4-2-3-5-14(13)17(23)10-20(25)22-16-9-19-18(8-15(16)21)26-11-27-19/h2-9,17H,10-11H2,1H3,(H,22,25)