4-(2-azanylethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)hexanedioic acid

Systemtic Name: 4-(2-azanylethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)hexanedioic acid Openeye Name: 4-(2-aminoethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)hexanedioic acid CAS Name: 4-(2-aminoethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)hexanedioic acid IUPAC Name: 4-(2-aminoethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)hexanedioic acid Traditional Name: 4-(2-aminoethylamino)-3-[bis(carboxymethyl)amino]-3-(carboxymethyl)adipic acid Formula: C14H23N3O10 MolecularWeight: 393.34652

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(CC(=O)O)C(CC(=O)O)(CC(=O)O)N(CC(=O)O)CC(=O)O)N

Isomeric SMILES

C(CNC(CC(=O)O)C(CC(=O)O)(CC(=O)O)N(CC(=O)O)CC(=O)O)N

InChI

InChI=1S/C14H23N3O10/c15-1-2-16-8(3-9(18)19)14(4-10(20)21,5-11(22)23)17(6-12(24)25)7-13(26)27/h8,16H,1-7,15H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)