3-[4-[(5-cyano-4-propan-2-yloxy-quinolin-3-yl)methoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[(5-cyano-4-propan-2-yloxy-quinolin-3-yl)methoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[4-[(5-cyano-4-isopropoxy-3-quinolyl)methoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[4-[(5-cyano-4-propan-2-yloxy-3-quinolinyl)methoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[(5-cyano-4-propan-2-yloxyquinolin-3-yl)methoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[4-[(5-cyano-4-isopropoxy-3-quinolyl)methoxy]phenyl]-2-ethoxy-propionic acid Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC2=C(C3=C(C=CC=C3N=C2)C#N)OC(C)C)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCC2=C(C3=C(C=CC=C3N=C2)C#N)OC(C)C)C(=O)O

InChI

InChI=1S/C25H26N2O5/c1-4-30-22(25(28)29)12-17-8-10-20(11-9-17)31-15-19-14-27-21-7-5-6-18(13-26)23(21)24(19)32-16(2)3/h5-11,14,16,22H,4,12,15H2,1-3H3,(H,28,29)