2-azanylethyl-[5,10-bis(oxidanylidene)-1,4-oxazecan-2-yl]-(3-chloranyl-2-oxidanyl-propyl)azanium

Systemtic Name: 2-azanylethyl-[5,10-bis(oxidanylidene)-1,4-oxazecan-2-yl]-(3-chloranyl-2-oxidanyl-propyl)azanium Openeye Name: 2-aminoethyl-(3-chloro-2-hydroxy-propyl)-(5,10-dioxo-1,4-oxazecan-2-yl)ammonium CAS Name: 2-aminoethyl-(3-chloro-2-hydroxypropyl)-(5,10-dioxo-1,4-oxazecan-2-yl)ammonium IUPAC Name: 2-aminoethyl-(3-chloro-2-hydroxypropyl)-(5,10-dioxo-1,4-oxazecan-2-yl)azanium Traditional Name: 2-aminoethyl-(3-chloro-2-hydroxy-propyl)-(5,10-diketo-1,4-oxazecan-2-yl)ammonium Formula: C13H25ClN3O4+ MolecularWeight: 322.8083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)OC(CNC(=O)C1)[NH+](CCN)CC(CCl)O

Isomeric SMILES

C1CCC(=O)OC(CNC(=O)C1)[NH+](CCN)CC(CCl)O

InChI

InChI=1S/C13H24ClN3O4/c14-7-10(18)9-17(6-5-15)12-8-16-11(19)3-1-2-4-13(20)21-12/h10,12,18H,1-9,15H2,(H,16,19)/p+1