2-[[4-azanyl-2-[bis(carboxymethyl)amino]cyclohexyl]amino]propanedioic acid

Systemtic Name: 2-[[4-azanyl-2-[bis(carboxymethyl)amino]cyclohexyl]amino]propanedioic acid Openeye Name: 2-[[4-amino-2-[bis(carboxymethyl)amino]cyclohexyl]amino]propanedioic acid CAS Name: 2-[[4-amino-2-[bis(carboxymethyl)amino]cyclohexyl]amino]propanedioic acid IUPAC Name: 2-[[4-amino-2-[bis(carboxymethyl)amino]cyclohexyl]amino]propanedioic acid Traditional Name: 2-[[4-amino-2-[bis(carboxymethyl)amino]cyclohexyl]amino]malonic acid Formula: C13H21N3O8 MolecularWeight: 347.32114

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1N)N(CC(=O)O)CC(=O)O)NC(C(=O)O)C(=O)O

Isomeric SMILES

C1CC(C(CC1N)N(CC(=O)O)CC(=O)O)NC(C(=O)O)C(=O)O

InChI

InChI=1S/C13H21N3O8/c14-6-1-2-7(15-11(12(21)22)13(23)24)8(3-6)16(4-9(17)18)5-10(19)20/h6-8,11,15H,1-5,14H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)