2-[[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-quinolin-2-yl]methoxy]-5-methyl-phenyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-quinolin-2-yl]methoxy]-5-methyl-phenyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-2-quinolyl]methoxy]-N-(carboxymethyl)-5-methyl-anilino]acetic acid CAS Name: 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-2-quinolinyl]methoxy]-N-(carboxymethyl)-5-methylanilino]acetic acid IUPAC Name: 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxyquinolin-2-yl]methoxy]-N-(carboxymethyl)-5-methylanilino]acetic acid Traditional Name: 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-2-quinolyl]methoxy]-N-(carboxymethyl)-5-methyl-anilino]acetic acid Formula: C26H27N3O10 MolecularWeight: 541.50668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NC3=C(C=C(C=C3C=C2)OC)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NC3=C(C=C(C=C3C=C2)OC)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C26H27N3O10/c1-15-3-6-21(19(7-15)28(10-22(30)31)11-23(32)33)39-14-17-5-4-16-8-18(38-2)9-20(26(16)27-17)29(12-24(34)35)13-25(36)37/h3-9H,10-14H2,1-2H3,(H,30,31)(H,32,33)(H,34,35)(H,36,37)