3-[4-[2-[butan-2-ylcarbamoyl(3-phenylpropyl)amino]ethoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[2-[butan-2-ylcarbamoyl(3-phenylpropyl)amino]ethoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[3-phenylpropyl(sec-butylcarbamoyl)amino]ethoxy]phenyl]propanoic acid CAS Name: 3-[4-[2-[[(butan-2-ylamino)-oxomethyl]-(3-phenylpropyl)amino]ethoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[2-[butan-2-ylcarbamoyl(3-phenylpropyl)amino]ethoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[3-phenylpropyl(sec-butylcarbamoyl)amino]ethoxy]phenyl]propionic acid Formula: C27H38N2O5 MolecularWeight: 470.60102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)N(CCCC1=CC=CC=C1)CCOC2=CC=C(C=C2)CC(C(=O)O)OCC

Isomeric SMILES

CCC(C)NC(=O)N(CCCC1=CC=CC=C1)CCOC2=CC=C(C=C2)CC(C(=O)O)OCC

InChI

InChI=1S/C27H38N2O5/c1-4-21(3)28-27(32)29(17-9-12-22-10-7-6-8-11-22)18-19-34-24-15-13-23(14-16-24)20-25(26(30)31)33-5-2/h6-8,10-11,13-16,21,25H,4-5,9,12,17-20H2,1-3H3,(H,28,32)(H,30,31)