methanetriol; 1,4,7,10-tetrazacyclododecane

Systemtic Name: methanetriol; 1,4,7,10-tetrazacyclododecane Openeye Name: methanetriol; 1,4,7,10-tetrazacyclododecane CAS Name: methanetriol; 1,4,7,10-tetrazacyclododecane IUPAC Name: methanetriol; 1,4,7,10-tetrazacyclododecane Traditional Name: methanetriol; 1,4,7,10-tetrazacyclododecane Formula: C9H24N4O3 MolecularWeight: 236.31186

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCNCCN1.C(O)(O)O

Isomeric SMILES

C1CNCCNCCNCCN1.C(O)(O)O

InChI

InChI=1S/C8H20N4.CH4O3/c1-2-10-5-6-12-8-7-11-4-3-9-1;2-1(3)4/h9-12H,1-8H2;1-4H