3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride

Systemtic Name: 3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride Openeye Name: 3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride CAS Name: 3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride IUPAC Name: 3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride Traditional Name: 3-(diethylaminomethyl)-2,3-dihydro-1,4-benzodioxepin-5-one hydrochloride Formula: C14H20ClNO3 MolecularWeight: 285.7665

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1COC2=CC=CC=C2C(=O)O1.Cl

Isomeric SMILES

CCN(CC)CC1COC2=CC=CC=C2C(=O)O1.Cl

InChI

InChI=1S/C14H19NO3.ClH/c1-3-15(4-2)9-11-10-17-13-8-6-5-7-12(13)14(16)18-11;/h5-8,11H,3-4,9-10H2,1-2H3;1H