3-[2,2-bis(azanyl)ethoxy]-3,4-bis(carboxymethyl)-4-oxidanyl-hexanedioic acid

Systemtic Name: 3-[2,2-bis(azanyl)ethoxy]-3,4-bis(carboxymethyl)-4-oxidanyl-hexanedioic acid Openeye Name: 3,4-bis(carboxymethyl)-3-(2,2-diaminoethoxy)-4-hydroxy-hexanedioic acid CAS Name: 3,4-bis(carboxymethyl)-3-(2,2-diaminoethoxy)-4-hydroxyhexanedioic acid IUPAC Name: 3,4-bis(carboxymethyl)-3-(2,2-diaminoethoxy)-4-hydroxyhexanedioic acid Traditional Name: 3,4-bis(carboxymethyl)-3-(2,2-diaminoethoxy)-4-hydroxy-adipic acid Formula: C12H20N2O10 MolecularWeight: 352.2946

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Descriptors Computed from Structure

Canonical SMILES:

C(C(N)N)OC(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)O

Isomeric SMILES

C(C(N)N)OC(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)O

InChI

InChI=1S/C12H20N2O10/c13-6(14)5-24-12(3-9(19)20,4-10(21)22)11(23,1-7(15)16)2-8(17)18/h6,23H,1-5,13-14H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)