methyl 3-[[4-bromanyl-2-(diethylaminomethyl)phenoxy]methyl]benzoate hydrochloride

Systemtic Name: methyl 3-[[4-bromanyl-2-(diethylaminomethyl)phenoxy]methyl]benzoate hydrochloride Openeye Name: methyl 3-[[4-bromo-2-(diethylaminomethyl)phenoxy]methyl]benzoate hydrochloride CAS Name: 3-[[4-bromo-2-(diethylaminomethyl)phenoxy]methyl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 3-[[4-bromo-2-(diethylaminomethyl)phenoxy]methyl]benzoate hydrochloride Traditional Name: 3-[[4-bromo-2-(diethylaminomethyl)phenoxy]methyl]benzoic acid methyl ester hydrochloride Formula: C20H25BrClNO3 MolecularWeight: 442.7744

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)Br)OCC2=CC=CC(=C2)C(=O)OC.Cl

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)Br)OCC2=CC=CC(=C2)C(=O)OC.Cl

InChI

InChI=1S/C20H24BrNO3.ClH/c1-4-22(5-2)13-17-12-18(21)9-10-19(17)25-14-15-7-6-8-16(11-15)20(23)24-3;/h6-12H,4-5,13-14H2,1-3H3;1H