2-[2-[3-[1-(carboxymethyl)quinolin-1-ium-2-yl]prop-2-enylidene]quinolin-1-yl]ethanoic acid

Systemtic Name: 2-[2-[3-[1-(carboxymethyl)quinolin-1-ium-2-yl]prop-2-enylidene]quinolin-1-yl]ethanoic acid Openeye Name: 2-[2-[3-[1-(carboxymethyl)quinolin-1-ium-2-yl]prop-2-enylidene]-1-quinolyl]acetic acid CAS Name: 2-[2-[3-[1-(carboxymethyl)-2-quinolin-1-iumyl]prop-2-enylidene]-1-quinolinyl]acetic acid IUPAC Name: 2-[2-[3-[1-(carboxymethyl)quinolin-1-ium-2-yl]prop-2-enylidene]quinolin-1-yl]acetic acid Traditional Name: 2-[2-[3-[1-(carboxymethyl)quinolin-1-ium-2-yl]prop-2-enylidene]-1-quinolyl]acetic acid Formula: C25H21N2O4+ MolecularWeight: 413.44524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=CC=CC3=[N+](C4=CC=CC=C4C=C3)CC(=O)O)N2CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=CC=CC3=[N+](C4=CC=CC=C4C=C3)CC(=O)O)N2CC(=O)O

InChI

InChI=1S/C25H20N2O4/c28-24(29)16-26-20(14-12-18-6-1-3-10-22(18)26)8-5-9-21-15-13-19-7-2-4-11-23(19)27(21)17-25(30)31/h1-15H,16-17H2,(H-,28,29,30,31)/p+1