3-[4-[1-(butan-2-ylcarbamoylamino)nonoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[1-(butan-2-ylcarbamoylamino)nonoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 2-ethoxy-3-[4-[1-(sec-butylcarbamoylamino)nonoxy]phenyl]propanoic acid CAS Name: 3-[4-[1-[[(butan-2-ylamino)-oxomethyl]amino]nonoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[1-(butan-2-ylcarbamoylamino)nonoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 2-ethoxy-3-[4-[1-(sec-butylcarbamoylamino)nonoxy]phenyl]propionic acid Formula: C25H42N2O5 MolecularWeight: 450.61138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(NC(=O)NC(C)CC)OC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCCCCCCCC(NC(=O)NC(C)CC)OC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C25H42N2O5/c1-5-8-9-10-11-12-13-23(27-25(30)26-19(4)6-2)32-21-16-14-20(15-17-21)18-22(24(28)29)31-7-3/h14-17,19,22-23H,5-13,18H2,1-4H3,(H,28,29)(H2,26,27,30)