1-chloranylbutane; tris[2,3-bis(oxidanyl)propyl]azanium

Systemtic Name: 1-chloranylbutane; tris[2,3-bis(oxidanyl)propyl]azanium Openeye Name: 1-chlorobutane; tris(2,3-dihydroxypropyl)ammonium CAS Name: 1-chlorobutane; tris(2,3-dihydroxypropyl)ammonium IUPAC Name: 1-chlorobutane; tris(2,3-dihydroxypropyl)azanium Traditional Name: 1-chlorobutane; triglycerylammonium Formula: C13H31ClNO6+ MolecularWeight: 332.84134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCl.C(C(CO)O)[NH+](CC(CO)O)CC(CO)O

Isomeric SMILES

CCCCCl.C(C(CO)O)[NH+](CC(CO)O)CC(CO)O

InChI

InChI=1S/C9H21NO6.C4H9Cl/c11-4-7(14)1-10(2-8(15)5-12)3-9(16)6-13;1-2-3-4-5/h7-9,11-16H,1-6H2;2-4H2,1H3/p+1