3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-one hydrochloride

Systemtic Name: 3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-one hydrochloride Openeye Name: 3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-one hydrochloride CAS Name: 3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-propanone hydrochloride IUPAC Name: 3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-one hydrochloride Traditional Name: 3-(diethylamino)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propan-1-one hydrochloride Formula: C16H24ClNO3 MolecularWeight: 313.81966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2.Cl

Isomeric SMILES

CCN(CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2.Cl

InChI

InChI=1S/C16H23NO3.ClH/c1-3-17(4-2)9-8-14(18)13-6-7-15-16(12-13)20-11-5-10-19-15;/h6-7,12H,3-5,8-11H2,1-2H3;1H