3-[3-[butan-2-yloxycarbonyl(heptyl)amino]propoxy]-2-ethoxy-2-phenyl-propanoic acid

Systemtic Name: 3-[3-[butan-2-yloxycarbonyl(heptyl)amino]propoxy]-2-ethoxy-2-phenyl-propanoic acid Openeye Name: 2-ethoxy-3-[3-[heptyl(sec-butoxycarbonyl)amino]propoxy]-2-phenyl-propanoic acid CAS Name: 3-[3-[[butan-2-yloxy(oxo)methyl]-heptylamino]propoxy]-2-ethoxy-2-phenylpropanoic acid IUPAC Name: 3-[3-[butan-2-yloxycarbonyl(heptyl)amino]propoxy]-2-ethoxy-2-phenylpropanoic acid Traditional Name: 2-ethoxy-3-[3-[heptyl(sec-butoxycarbonyl)amino]propoxy]-2-phenyl-propionic acid Formula: C26H43NO6 MolecularWeight: 465.62272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OC(C)CC

Isomeric SMILES

CCCCCCCN(CCCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OC(C)CC

InChI

InChI=1S/C26H43NO6/c1-5-8-9-10-14-18-27(25(30)33-22(4)6-2)19-15-20-31-21-26(24(28)29,32-7-3)23-16-12-11-13-17-23/h11-13,16-17,22H,5-10,14-15,18-21H2,1-4H3,(H,28,29)