methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-oxidanyl-ethyl]-2-methoxy-benzoate hydrochloride

Systemtic Name: methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-oxidanyl-ethyl]-2-methoxy-benzoate hydrochloride Openeye Name: methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-hydroxy-ethyl]-2-methoxy-benzoate hydrochloride CAS Name: 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-hydroxyethyl]-2-methoxybenzoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-hydroxyethyl]-2-methoxybenzoate hydrochloride Traditional Name: 5-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1-hydroxy-ethyl]-2-methoxy-benzoic acid methyl ester hydrochloride Formula: C20H24ClNO6 MolecularWeight: 409.86066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNCC2COC3=CC=CC=C3O2)O)C(=O)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNCC2COC3=CC=CC=C3O2)O)C(=O)OC.Cl

InChI

InChI=1S/C20H23NO6.ClH/c1-24-17-8-7-13(9-15(17)20(23)25-2)16(22)11-21-10-14-12-26-18-5-3-4-6-19(18)27-14;/h3-9,14,16,21-22H,10-12H2,1-2H3;1H