3-[4-[2-(butan-2-yloxycarbonylamino)-4-methyl-pentoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[2-(butan-2-yloxycarbonylamino)-4-methyl-pentoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 2-ethoxy-3-[4-[4-methyl-2-(sec-butoxycarbonylamino)pentoxy]phenyl]propanoic acid CAS Name: 3-[4-[2-[[butan-2-yloxy(oxo)methyl]amino]-4-methylpentoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[2-(butan-2-yloxycarbonylamino)-4-methylpentoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 2-ethoxy-3-[4-[4-methyl-2-(sec-butoxycarbonylamino)pentoxy]phenyl]propionic acid Formula: C22H35NO6 MolecularWeight: 409.5164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)NC(CC(C)C)COC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCC(C)OC(=O)NC(CC(C)C)COC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C22H35NO6/c1-6-16(5)29-22(26)23-18(12-15(3)4)14-28-19-10-8-17(9-11-19)13-20(21(24)25)27-7-2/h8-11,15-16,18,20H,6-7,12-14H2,1-5H3,(H,23,26)(H,24,25)