4-[1-(dimethylamino)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxidanylidene-butanoic acid hydrochloride

Systemtic Name: 4-[1-(dimethylamino)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 4-[1-(dimethylaminomethyl)-2-(2-phenethylphenoxy)ethoxy]-4-oxo-butanoic acid hydrochloride CAS Name: 4-[1-(dimethylamino)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxobutanoic acid hydrochloride IUPAC Name: 4-[1-(dimethylamino)-3-(2-phenethylphenoxy)propan-2-yl]oxy-4-oxobutanoic acid hydrochloride Traditional Name: 4-[1-(dimethylaminomethyl)-2-(2-phenethylphenoxy)ethoxy]-4-keto-butyric acid hydrochloride Formula: C23H30ClNO5 MolecularWeight: 435.941

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=CC=C1CCC2=CC=CC=C2)OC(=O)CCC(=O)O.Cl

Isomeric SMILES

CN(C)CC(COC1=CC=CC=C1CCC2=CC=CC=C2)OC(=O)CCC(=O)O.Cl

InChI

InChI=1S/C23H29NO5.ClH/c1-24(2)16-20(29-23(27)15-14-22(25)26)17-28-21-11-7-6-10-19(21)13-12-18-8-4-3-5-9-18;/h3-11,20H,12-17H2,1-2H3,(H,25,26);1H