2-[[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-4-[tris(fluoranyl)methyl]phenyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-4-[tris(fluoranyl)methyl]phenyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-N-(carboxymethyl)-4-[tris(fluoranyl)methyl]anilino]acetic acid CAS Name: 2-[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-N-(carboxymethyl)-4-[tris(fluoranyl)methyl]anilino]acetic acid IUPAC Name: 2-[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-N-(carboxymethyl)-4-[tris(fluoranyl)methyl]anilino]acetic acid Traditional Name: 2-[2-[2-[2-[bis(carboxymethyl)amino]-5-[tris(fluoranyl)methyl]phenoxy]ethoxy]-N-(carboxymethyl)-4-[tris(fluoranyl)methyl]anilino]acetic acid Formula: C24H22F6N2O10 MolecularWeight: 612.429299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)OCCOC2=C(C=CC(=C2)C(F)(F)F)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C([19F])([19F])[19F])OCCOC2=C(C=CC(=C2)C([19F])([19F])[19F])N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C24H22F6N2O10/c25-23(26,27)13-1-3-15(31(9-19(33)34)10-20(35)36)17(7-13)41-5-6-42-18-8-14(24(28,29)30)2-4-16(18)32(11-21(37)38)12-22(39)40/h1-4,7-8H,5-6,9-12H2,(H,33,34)(H,35,36)(H,37,38)(H,39,40)/i25+0,26+0,27+0,28+0,29+0,30+0