3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)hexanedioic acid

Systemtic Name: 3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)hexanedioic acid Openeye Name: 3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)hexanedioic acid CAS Name: 3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)hexanedioic acid IUPAC Name: 3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)hexanedioic acid Traditional Name: 3-(aminomethyl)-3,4-bis(carboxymethyl)-4-(2-hydroxyethylamino)adipic acid Formula: C13H22N2O9 MolecularWeight: 350.32178

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)NC(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)CN

Isomeric SMILES

C(CO)NC(CC(=O)O)(CC(=O)O)C(CC(=O)O)(CC(=O)O)CN

InChI

InChI=1S/C13H22N2O9/c14-7-12(3-8(17)18,4-9(19)20)13(5-10(21)22,6-11(23)24)15-1-2-16/h15-16H,1-7,14H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)