2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]ethanoic acid

Systemtic Name: 2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]ethanoic acid Openeye Name: 2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]acetic acid CAS Name: 2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]acetic acid IUPAC Name: 2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]acetic acid Traditional Name: 2-[1,2-bis(carboxymethyl)-1,5,9-triazacyclododec-2-yl]acetic acid Formula: C15H27N3O6 MolecularWeight: 345.39138

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCCN(C(CCNC1)(CC(=O)O)CC(=O)O)CC(=O)O

Isomeric SMILES

C1CNCCCN(C(CCNC1)(CC(=O)O)CC(=O)O)CC(=O)O

InChI

InChI=1S/C15H27N3O6/c19-12(20)9-15(10-13(21)22)3-7-17-5-1-4-16-6-2-8-18(15)11-14(23)24/h16-17H,1-11H2,(H,19,20)(H,21,22)(H,23,24)