3-azanyl-3,4-bis(carboxymethyl)-4-(carboxymethylamino)hexanedioic acid

Systemtic Name: 3-azanyl-3,4-bis(carboxymethyl)-4-(carboxymethylamino)hexanedioic acid Openeye Name: 3-amino-3,4-bis(carboxymethyl)-4-(carboxymethylamino)hexanedioic acid CAS Name: 3-amino-3,4-bis(carboxymethyl)-4-(carboxymethylamino)hexanedioic acid IUPAC Name: 3-amino-3,4-bis(carboxymethyl)-4-(carboxymethylamino)hexanedioic acid Traditional Name: 3-amino-3,4-bis(carboxymethyl)-4-(carboxymethylamino)adipic acid Formula: C12H18N2O10 MolecularWeight: 350.27872

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)C(CC(=O)O)(C(CC(=O)O)(CC(=O)O)NCC(=O)O)N

Isomeric SMILES

C(C(=O)O)C(CC(=O)O)(C(CC(=O)O)(CC(=O)O)NCC(=O)O)N

InChI

InChI=1S/C12H18N2O10/c13-11(1-6(15)16,2-7(17)18)12(3-8(19)20,4-9(21)22)14-5-10(23)24/h14H,1-5,13H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)(H,23,24)