2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]ethanoic acid; iron(3+)

Systemtic Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]ethanoic acid; iron(3+) Openeye Name: ferric 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid CAS Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid; iron(3+) IUPAC Name: 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid; iron(3+) Traditional Name: ferric 2-[[2-[bis(carboxymethyl)amino]cyclohexyl]-(carboxymethyl)amino]acetic acid Formula: C14H22FeN2O8+3 MolecularWeight: 402.17808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.[Fe+3]

Isomeric SMILES

C1CCC(C(C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.[Fe+3]

InChI

InChI=1S/C14H22N2O8.Fe/c17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24;/h9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24);/q;+3