2-ethoxy-3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenyl-propanoic acid

Systemtic Name: 2-ethoxy-3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenyl-propanoic acid Openeye Name: 3-[3-[tert-butoxycarbonyl(heptyl)amino]propoxy]-2-ethoxy-2-phenyl-propanoic acid CAS Name: 2-ethoxy-3-[3-[heptyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propoxy]-2-phenylpropanoic acid IUPAC Name: 2-ethoxy-3-[3-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propoxy]-2-phenylpropanoic acid Traditional Name: 3-[3-[tert-butoxycarbonyl(heptyl)amino]propoxy]-2-ethoxy-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)(C)C

Isomeric SMILES

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

InChI

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