2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H19NO3S/c21-19(20-8-7-14-3-1-2-4-15(14)12-20)13-24-16-5-6-17-18(11-16)23-10-9-22-17/h1-6,11H,7-10,12-13H2