4-[[3-(carboxymethyl)-2-methyl-5-(quinolin-2-ylmethoxy)indol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[3-(carboxymethyl)-2-methyl-5-(quinolin-2-ylmethoxy)indol-1-yl]methyl]benzoic acid Openeye Name: 4-[[3-(carboxymethyl)-2-methyl-5-(2-quinolylmethoxy)indol-1-yl]methyl]benzoic acid CAS Name: 4-[[3-(carboxymethyl)-2-methyl-5-(2-quinolinylmethoxy)-1-indolyl]methyl]benzoic acid IUPAC Name: 4-[[3-(carboxymethyl)-2-methyl-5-(quinolin-2-ylmethoxy)indol-1-yl]methyl]benzoic acid Traditional Name: 4-[[3-(carboxymethyl)-2-methyl-5-(2-quinolylmethoxy)indol-1-yl]methyl]benzoic acid Formula: C29H24N2O5 MolecularWeight: 480.51126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)C(=O)O)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)C(=O)O)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

InChI

InChI=1S/C29H24N2O5/c1-18-24(15-28(32)33)25-14-23(36-17-22-11-10-20-4-2-3-5-26(20)30-22)12-13-27(25)31(18)16-19-6-8-21(9-7-19)29(34)35/h2-14H,15-17H2,1H3,(H,32,33)(H,34,35)