3-(azepan-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one hydrochloride

Systemtic Name: 3-(azepan-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one hydrochloride Openeye Name: 3-(azepan-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one hydrochloride CAS Name: 3-(1-azepanyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-propanone hydrochloride IUPAC Name: 3-(azepan-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one hydrochloride Traditional Name: 3-(azepan-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propan-1-one hydrochloride Formula: C17H24ClNO3 MolecularWeight: 325.83036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCC(=O)C2=CC3=C(C=C2)OCCO3.Cl

Isomeric SMILES

C1CCCN(CC1)CCC(=O)C2=CC3=C(C=C2)OCCO3.Cl

InChI

InChI=1S/C17H23NO3.ClH/c19-15(7-10-18-8-3-1-2-4-9-18)14-5-6-16-17(13-14)21-12-11-20-16;/h5-6,13H,1-4,7-12H2;1H