6-(dimethylaminomethyl)-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]-4-oxidanylidene-heptanoic acid

Systemtic Name: 6-(dimethylaminomethyl)-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]-4-oxidanylidene-heptanoic acid Openeye Name: 6-(dimethylaminomethyl)-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]-4-oxo-heptanoic acid CAS Name: 6-(dimethylaminomethyl)-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]-4-oxoheptanoic acid IUPAC Name: 6-(dimethylaminomethyl)-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]-4-oxoheptanoic acid Traditional Name: 6-(dimethylaminomethyl)-4-keto-7-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]enanthic acid Formula: C25H33NO5 MolecularWeight: 427.53322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO5/c1-26(2)17-20(15-22(27)13-14-25(28)29)18-31-24-10-5-4-8-21(24)12-11-19-7-6-9-23(16-19)30-3/h4-10,16,20H,11-15,17-18H2,1-3H3,(H,28,29)