4-[1-(dimethylamino)-3-[2-(3-methoxyphenyl)-1-phenyl-ethoxy]propan-2-yl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-(dimethylamino)-3-[2-(3-methoxyphenyl)-1-phenyl-ethoxy]propan-2-yl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[1-(dimethylaminomethyl)-2-[2-(3-methoxyphenyl)-1-phenyl-ethoxy]ethoxy]-4-oxo-butanoic acid CAS Name: 4-[1-(dimethylamino)-3-[2-(3-methoxyphenyl)-1-phenylethoxy]propan-2-yl]oxy-4-oxobutanoic acid IUPAC Name: 4-[1-(dimethylamino)-3-[2-(3-methoxyphenyl)-1-phenylethoxy]propan-2-yl]oxy-4-oxobutanoic acid Traditional Name: 4-[1-(dimethylaminomethyl)-2-[2-(3-methoxyphenyl)-1-phenyl-ethoxy]ethoxy]-4-keto-butyric acid Formula: C24H31NO6 MolecularWeight: 429.50604

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC(CC1=CC(=CC=C1)OC)C2=CC=CC=C2)OC(=O)CCC(=O)O

Isomeric SMILES

CN(C)CC(COC(CC1=CC(=CC=C1)OC)C2=CC=CC=C2)OC(=O)CCC(=O)O

InChI

InChI=1S/C24H31NO6/c1-25(2)16-21(31-24(28)13-12-23(26)27)17-30-22(19-9-5-4-6-10-19)15-18-8-7-11-20(14-18)29-3/h4-11,14,21-22H,12-13,15-17H2,1-3H3,(H,26,27)