2-[3-(4-chlorophenyl)carbonyl-4-(quinolin-2-ylmethoxy)phenyl]propanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)carbonyl-4-(quinolin-2-ylmethoxy)phenyl]propanoic acid Openeye Name: 2-[3-(4-chlorobenzoyl)-4-(2-quinolylmethoxy)phenyl]propanoic acid CAS Name: 2-[3-[(4-chlorophenyl)-oxomethyl]-4-(2-quinolinylmethoxy)phenyl]propanoic acid IUPAC Name: 2-[3-(4-chlorobenzoyl)-4-(quinolin-2-ylmethoxy)phenyl]propanoic acid Traditional Name: 2-[3-(4-chlorobenzoyl)-4-(2-quinolylmethoxy)phenyl]propionic acid Formula: C26H20ClNO4 MolecularWeight: 445.8943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(=O)C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C(=O)C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C26H20ClNO4/c1-16(26(30)31)19-9-13-24(22(14-19)25(29)18-6-10-20(27)11-7-18)32-15-21-12-8-17-4-2-3-5-23(17)28-21/h2-14,16H,15H2,1H3,(H,30,31)