2-[4,7,10-tris(carboxymethyl)-7-(cyclododecyldiazenyl)cyclododecyl]ethanoic acid

Systemtic Name: 2-[4,7,10-tris(carboxymethyl)-7-(cyclododecyldiazenyl)cyclododecyl]ethanoic acid Openeye Name: 2-[4,7,10-tris(carboxymethyl)-7-cyclododecylazo-cyclododecyl]acetic acid CAS Name: 2-[4,7,10-tris(carboxymethyl)-7-cyclododecylazocyclododecyl]acetic acid IUPAC Name: 2-[4,7,10-tris(carboxymethyl)-7-(cyclododecyldiazenyl)cyclododecyl]acetic acid Traditional Name: 2-[4,7,10-tris(carboxymethyl)-7-cyclododecylazo-cyclododecyl]acetic acid Formula: C32H54N2O8 MolecularWeight: 594.77976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)N=NC2(CCC(CCC(CCC(CC2)CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O

Isomeric SMILES

C1CCCCCC(CCCCC1)N=NC2(CCC(CCC(CCC(CC2)CC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O

InChI

InChI=1S/C32H54N2O8/c35-28(36)20-24-12-14-25(21-29(37)38)16-18-32(23-31(41)42,19-17-26(15-13-24)22-30(39)40)34-33-27-10-8-6-4-2-1-3-5-7-9-11-27/h24-27H,1-23H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)