3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)decanedioic acid

Systemtic Name: 3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)decanedioic acid Openeye Name: 3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)decanedioic acid CAS Name: 3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)decanedioic acid IUPAC Name: 3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)decanedioic acid Traditional Name: 3,8-bis[bis(carboxymethyl)amino]-4,7-bis(carboxymethyloxy)sebacic acid Formula: C22H32N2O18 MolecularWeight: 612.49208

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(CC(=O)O)N(CC(=O)O)CC(=O)O)OCC(=O)O)C(C(CC(=O)O)N(CC(=O)O)CC(=O)O)OCC(=O)O

Isomeric SMILES

C(CC(C(CC(=O)O)N(CC(=O)O)CC(=O)O)OCC(=O)O)C(C(CC(=O)O)N(CC(=O)O)CC(=O)O)OCC(=O)O

InChI

InChI=1S/C22H32N2O18/c25-15(26)3-11(23(5-17(29)30)6-18(31)32)13(41-9-21(37)38)1-2-14(42-10-22(39)40)12(4-16(27)28)24(7-19(33)34)8-20(35)36/h11-14H,1-10H2,(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)