2-[[1,2-bis(2-azanylphenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]ethanoic acid

Systemtic Name: 2-[[1,2-bis(2-azanylphenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]ethanoic acid Openeye Name: 2-[[1,2-bis(2-aminophenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]acetic acid CAS Name: 2-[[1,2-bis(2-aminophenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]acetic acid IUPAC Name: 2-[[1,2-bis(2-aminophenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]acetic acid Traditional Name: 2-[[1,2-bis(2-aminophenoxy)-1,2,2-tris(carboxymethylamino)ethyl]amino]acetic acid Formula: C22H28N6O10 MolecularWeight: 536.49192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)OC(C(NCC(=O)O)(NCC(=O)O)OC2=CC=CC=C2N)(NCC(=O)O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)N)OC(C(NCC(=O)O)(NCC(=O)O)OC2=CC=CC=C2N)(NCC(=O)O)NCC(=O)O

InChI

InChI=1S/C22H28N6O10/c23-13-5-1-3-7-15(13)37-21(25-9-17(29)30,26-10-18(31)32)22(27-11-19(33)34,28-12-20(35)36)38-16-8-4-2-6-14(16)24/h1-8,25-28H,9-12,23-24H2,(H,29,30)(H,31,32)(H,33,34)(H,35,36)