2-[2-(1,3-benzodioxol-5-yl)ethyl]isoquinolin-1-one

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]isoquinolin-1-one Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]isoquinolin-1-one CAS Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-1-isoquinolinone IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]isoquinolin-1-one Traditional Name: 2-homopiperonylisocarbostyril Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCN3C=CC4=CC=CC=C4C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCN3C=CC4=CC=CC=C4C3=O

InChI

InChI=1S/C18H15NO3/c20-18-15-4-2-1-3-14(15)8-10-19(18)9-7-13-5-6-16-17(11-13)22-12-21-16/h1-6,8,10-11H,7,9,12H2