1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-pyridin-4-yl-ethanone hydrochloride

Systemtic Name: 1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-pyridin-4-yl-ethanone hydrochloride Openeye Name: 1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-(4-pyridyl)ethanone hydrochloride CAS Name: 1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-pyridin-4-ylethanone hydrochloride IUPAC Name: 1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-pyridin-4-ylethanone hydrochloride Traditional Name: 1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-2-(4-pyridyl)ethanone hydrochloride Formula: C16H16ClNO4 MolecularWeight: 321.75554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C(=O)CC3=CC=NC=C3)OCCO2.Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)C(=O)CC3=CC=NC=C3)OCCO2.Cl

InChI

InChI=1S/C16H15NO4.ClH/c1-19-14-3-2-12(15-16(14)21-9-8-20-15)13(18)10-11-4-6-17-7-5-11;/h2-7H,8-10H2,1H3;1H