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

Systemtic Name: 2-ethoxy-3-[2-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-2-phenyl-propanoic acid Openeye Name: 3-[2-[tert-butoxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propanoic acid CAS Name: 2-ethoxy-3-[2-[heptyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethoxy]-2-phenylpropanoic acid IUPAC Name: 2-ethoxy-3-[2-[heptyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-2-phenylpropanoic acid Traditional Name: 3-[2-[tert-butoxycarbonyl(heptyl)amino]ethoxy]-2-ethoxy-2-phenyl-propionic acid Formula: C25H41NO6 MolecularWeight: 451.59614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H41NO6/c1-6-8-9-10-14-17-26(23(29)32-24(3,4)5)18-19-30-20-25(22(27)28,31-7-2)21-15-12-11-13-16-21/h11-13,15-16H,6-10,14,17-20H2,1-5H3,(H,27,28)