2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]ethanoic acid

Systemtic Name: 2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]ethanoic acid Openeye Name: 2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]acetic acid CAS Name: 2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]acetic acid IUPAC Name: 2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]acetic acid Traditional Name: 2-[4-(carboxymethyl)-1,4,8,11-tetrazacyclotetradec-1-yl]acetic acid Formula: C14H28N4O4 MolecularWeight: 316.39652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCN(C1)CC(=O)O)CC(=O)O

Isomeric SMILES

C1CNCCNCCCN(CCN(C1)CC(=O)O)CC(=O)O

InChI

InChI=1S/C14H28N4O4/c19-13(20)11-17-7-1-3-15-5-6-16-4-2-8-18(10-9-17)12-14(21)22/h15-16H,1-12H2,(H,19,20)(H,21,22)