2-[[3-azanyl-2,4,4-tris(carboxymethylamino)pentan-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[3-azanyl-2,4,4-tris(carboxymethylamino)pentan-2-yl]amino]ethanoic acid Openeye Name: 2-[[2-amino-1,3,3-tris(carboxymethylamino)-1-methyl-butyl]amino]acetic acid CAS Name: 2-[[3-amino-2,4,4-tris(carboxymethylamino)pentan-2-yl]amino]acetic acid IUPAC Name: 2-[[3-amino-2,4,4-tris(carboxymethylamino)pentan-2-yl]amino]acetic acid Traditional Name: 2-[[2-amino-1,3,3-tris(carboxymethylamino)-1-methyl-butyl]amino]acetic acid Formula: C13H25N5O8 MolecularWeight: 379.3663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H25N5O8/c1-12(15-3-7(19)20,16-4-8(21)22)11(14)13(2,17-5-9(23)24)18-6-10(25)26/h11,15-18H,3-6,14H2,1-2H3,(H,19,20)(H,21,22)(H,23,24)(H,25,26)