2-methyl-6-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid

Systemtic Name: 2-methyl-6-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid Openeye Name: 2-methyl-6-[[3-(2-quinolylmethoxy)phenyl]methoxymethyl]benzoic acid CAS Name: 2-methyl-6-[[3-(2-quinolinylmethoxy)phenyl]methoxymethyl]benzoic acid IUPAC Name: 2-methyl-6-[[3-(quinolin-2-ylmethoxy)phenyl]methoxymethyl]benzoic acid Traditional Name: 2-methyl-6-[[3-(2-quinolylmethoxy)benzyl]oxymethyl]benzoic acid Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C26H23NO4/c1-18-6-4-9-21(25(18)26(28)29)16-30-15-19-7-5-10-23(14-19)31-17-22-13-12-20-8-2-3-11-24(20)27-22/h2-14H,15-17H2,1H3,(H,28,29)