2-[4-ethoxy-3-(quinolin-3-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 2-[4-ethoxy-3-(quinolin-3-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-[4-ethoxy-3-(3-quinolylmethoxycarbonylamino)phenyl]-2-isopropoxy-propanoic acid CAS Name: 2-[4-ethoxy-3-[[oxo(3-quinolinylmethoxy)methyl]amino]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 2-[4-ethoxy-3-(quinolin-3-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-[4-ethoxy-3-(3-quinolylmethoxycarbonylamino)phenyl]-2-isopropoxy-propionic acid Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)(C(=O)O)OC(C)C)NC(=O)OCC2=CC3=CC=CC=C3N=C2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)(C(=O)O)OC(C)C)NC(=O)OCC2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C25H28N2O6/c1-5-31-22-11-10-19(25(4,23(28)29)33-16(2)3)13-21(22)27-24(30)32-15-17-12-18-8-6-7-9-20(18)26-14-17/h6-14,16H,5,15H2,1-4H3,(H,27,30)(H,28,29)