methyl 3-azanyl-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propanoate

Systemtic Name: methyl 3-azanyl-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propanoate Openeye Name: methyl 3-amino-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propanoate CAS Name: 3-amino-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propanoic acid methyl ester IUPAC Name: methyl 3-amino-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propanoate Traditional Name: 3-amino-2-(4,7,10-triethyl-1,4,7,10-tetrazacyclododec-1-yl)propionic acid methyl ester Formula: C18H39N5O2 MolecularWeight: 357.53456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CCN(CCN(CC1)CC)C(CN)C(=O)OC)CC

Isomeric SMILES

CCN1CCN(CCN(CCN(CC1)CC)C(CN)C(=O)OC)CC

InChI

InChI=1S/C18H39N5O2/c1-5-20-8-10-21(6-2)12-14-23(17(16-19)18(24)25-4)15-13-22(7-3)11-9-20/h17H,5-16,19H2,1-4H3