11-(12-azanyl-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid

Systemtic Name: 11-(12-azanyl-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid Openeye Name: 11-(12-amino-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid CAS Name: 11-(12-amino-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid IUPAC Name: 11-(12-amino-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid Traditional Name: 11-(12-amino-1,4,7,10-tetrazacyclotridec-12-yl)undecanoic acid Formula: C20H43N5O2 MolecularWeight: 385.58772

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCC(CNCCN1)(CCCCCCCCCCC(=O)O)N

Isomeric SMILES

C1CNCCNCC(CNCCN1)(CCCCCCCCCCC(=O)O)N

InChI

InChI=1S/C20H43N5O2/c21-20(10-8-6-4-2-1-3-5-7-9-19(26)27)17-24-15-13-22-11-12-23-14-16-25-18-20/h22-25H,1-18,21H2,(H,26,27)