4-methyl-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoic acid

Systemtic Name: 4-methyl-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoic acid Openeye Name: 4-methyl-5-[3-(2-quinolylmethoxy)phenyl]pentanoic acid CAS Name: 4-methyl-5-[3-(2-quinolinylmethoxy)phenyl]pentanoic acid IUPAC Name: 4-methyl-5-[3-(quinolin-2-ylmethoxy)phenyl]pentanoic acid Traditional Name: 4-methyl-5-[3-(2-quinolylmethoxy)phenyl]valeric acid Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)CC1=CC(=CC=C1)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CCC(=O)O)CC1=CC(=CC=C1)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H23NO3/c1-16(9-12-22(24)25)13-17-5-4-7-20(14-17)26-15-19-11-10-18-6-2-3-8-21(18)23-19/h2-8,10-11,14,16H,9,12-13,15H2,1H3,(H,24,25)