2-[5-methoxy-2-methyl-1-(quinolin-2-ylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-2-methyl-1-(quinolin-2-ylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-[5-methoxy-2-methyl-1-(2-quinolylmethyl)indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-2-methyl-1-(2-quinolinylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-[5-methoxy-2-methyl-1-(quinolin-2-ylmethyl)indol-3-yl]acetic acid Traditional Name: 2-[5-methoxy-2-methyl-1-(2-quinolylmethyl)indol-3-yl]acetic acid Formula: C22H20N2O3 MolecularWeight: 360.4058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=NC4=CC=CC=C4C=C3)C=CC(=C2)OC)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=NC4=CC=CC=C4C=C3)C=CC(=C2)OC)CC(=O)O

InChI

InChI=1S/C22H20N2O3/c1-14-18(12-22(25)26)19-11-17(27-2)9-10-21(19)24(14)13-16-8-7-15-5-3-4-6-20(15)23-16/h3-11H,12-13H2,1-2H3,(H,25,26)