3-[3-[[(4-ethoxyphenoxy)carbonylamino]methyl]phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[3-[[(4-ethoxyphenoxy)carbonylamino]methyl]phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 3-[3-[[(4-ethoxyphenoxy)carbonylamino]methyl]phenyl]-2-isopropoxy-propanoic acid CAS Name: 3-[3-[[[(4-ethoxyphenoxy)-oxomethyl]amino]methyl]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[3-[[(4-ethoxyphenoxy)carbonylamino]methyl]phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 3-[3-[[(4-ethoxyphenoxy)carbonylamino]methyl]phenyl]-2-isopropoxy-propionic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(=O)NCC2=CC=CC(=C2)CC(C(=O)O)OC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(=O)NCC2=CC=CC(=C2)CC(C(=O)O)OC(C)C

InChI

InChI=1S/C22H27NO6/c1-4-27-18-8-10-19(11-9-18)29-22(26)23-14-17-7-5-6-16(12-17)13-20(21(24)25)28-15(2)3/h5-12,15,20H,4,13-14H2,1-3H3,(H,23,26)(H,24,25)