1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one hydrochloride

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one hydrochloride Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one hydrochloride CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-butanone hydrochloride IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one hydrochloride Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one hydrochloride Formula: C21H24ClNO3 MolecularWeight: 373.87316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCC(=O)C3=CC4=C(C=C3)OCCO4.Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCC(=O)C3=CC4=C(C=C3)OCCO4.Cl

InChI

InChI=1S/C21H23NO3.ClH/c23-19(17-7-8-20-21(14-17)25-13-12-24-20)6-3-10-22-11-9-16-4-1-2-5-18(16)15-22;/h1-2,4-5,7-8,14H,3,6,9-13,15H2;1H