3-[3-[heptyl(propan-2-yloxycarbonyl)amino]propoxy]-2-phenyl-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[heptyl(propan-2-yloxycarbonyl)amino]propoxy]-2-phenyl-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[heptyl(isopropoxycarbonyl)amino]propoxy]-2-isopropoxy-2-phenyl-propanoic acid CAS Name: 3-[3-[heptyl-[oxo(propan-2-yloxy)methyl]amino]propoxy]-2-phenyl-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[heptyl(propan-2-yloxycarbonyl)amino]propoxy]-2-phenyl-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[heptyl(isopropoxycarbonyl)amino]propoxy]-2-isopropoxy-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)OC(C)C)C(=O)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H43NO6/c1-6-7-8-9-13-17-27(25(30)32-21(2)3)18-14-19-31-20-26(24(28)29,33-22(4)5)23-15-11-10-12-16-23/h10-12,15-16,21-22H,6-9,13-14,17-20H2,1-5H3,(H,28,29)