N-(1,3-benzodioxol-5-ylmethyl)-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-piperonyl-acetamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O4/c1-14(24)23-9-8-16-4-2-3-5-17(16)18(23)11-21(25)22-12-15-6-7-19-20(10-15)27-13-26-19/h2-10,18H,11-13H2,1H3,(H,22,25)/t18-/m0/s1