3-[2-[cyclohexyloxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propanoic acid

Systemtic Name: 3-[2-[cyclohexyloxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propanoic acid Openeye Name: 3-[2-[cyclohexoxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propanoic acid CAS Name: 3-[2-[[cyclohexyloxy(oxo)methyl]-heptylamino]ethoxy]-2-ethoxy-2-phenylpropanoic acid IUPAC Name: 3-[2-[cyclohexyloxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenylpropanoic acid Traditional Name: 3-[2-[cyclohexoxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propionic acid Formula: C27H43NO6 MolecularWeight: 477.63342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OC2CCCCC2

Isomeric SMILES

CCCCCCCN(CCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OC2CCCCC2

InChI

InChI=1S/C27H43NO6/c1-3-5-6-7-14-19-28(26(31)34-24-17-12-9-13-18-24)20-21-32-22-27(25(29)30,33-4-2)23-15-10-8-11-16-23/h8,10-11,15-16,24H,3-7,9,12-14,17-22H2,1-2H3,(H,29,30)