2-ethoxy-3-[4-[2-[2-methoxyethoxycarbonyl(4-methylpentyl)amino]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[2-methoxyethoxycarbonyl(4-methylpentyl)amino]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[isohexyl(2-methoxyethoxycarbonyl)amino]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[[2-methoxyethoxy(oxo)methyl]-(4-methylpentyl)amino]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[2-methoxyethoxycarbonyl(4-methylpentyl)amino]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[isohexyl(2-methoxyethoxycarbonyl)amino]ethoxy]phenyl]propionic acid Formula: C23H37NO7 MolecularWeight: 439.54238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN(CCCC(C)C)C(=O)OCCOC)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN(CCCC(C)C)C(=O)OCCOC)C(=O)O

InChI

InChI=1S/C23H37NO7/c1-5-29-21(22(25)26)17-19-8-10-20(11-9-19)30-14-13-24(12-6-7-18(2)3)23(27)31-16-15-28-4/h8-11,18,21H,5-7,12-17H2,1-4H3,(H,25,26)