2-ethoxy-3-[2-[octyl(phenylmethoxycarbonyl)amino]ethoxy]-2-phenyl-propanoic acid

Systemtic Name: 2-ethoxy-3-[2-[octyl(phenylmethoxycarbonyl)amino]ethoxy]-2-phenyl-propanoic acid Openeye Name: 3-[2-[benzyloxycarbonyl(octyl)amino]ethoxy]-2-ethoxy-2-phenyl-propanoic acid CAS Name: 2-ethoxy-3-[2-[octyl(phenylmethoxycarbonyl)amino]ethoxy]-2-phenylpropanoic acid IUPAC Name: 2-ethoxy-3-[2-[octyl(phenylmethoxycarbonyl)amino]ethoxy]-2-phenylpropanoic acid Traditional Name: 3-[2-[carbobenzoxy(octyl)amino]ethoxy]-2-ethoxy-2-phenyl-propionic acid Formula: C29H41NO6 MolecularWeight: 499.63894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCN(CCOCC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C29H41NO6/c1-3-5-6-7-8-15-20-30(28(33)35-23-25-16-11-9-12-17-25)21-22-34-24-29(27(31)32,36-4-2)26-18-13-10-14-19-26/h9-14,16-19H,3-8,15,20-24H2,1-2H3,(H,31,32)