2-azanylethyl-(3-chloranyl-2-oxidanyl-propyl)-[2-[(6-oxidanyl-6-oxidanylidene-hexanoyl)amino]ethyl]azanium

Systemtic Name: 2-azanylethyl-(3-chloranyl-2-oxidanyl-propyl)-[2-[(6-oxidanyl-6-oxidanylidene-hexanoyl)amino]ethyl]azanium Openeye Name: 2-aminoethyl-(3-chloro-2-hydroxy-propyl)-[2-[(6-hydroxy-6-oxo-hexanoyl)amino]ethyl]ammonium CAS Name: 2-aminoethyl-(3-chloro-2-hydroxypropyl)-[2-[(6-hydroxy-1,6-dioxohexyl)amino]ethyl]ammonium IUPAC Name: 2-aminoethyl-(3-chloro-2-hydroxypropyl)-[2-[(6-hydroxy-6-oxohexanoyl)amino]ethyl]azanium Traditional Name: 2-aminoethyl-(3-chloro-2-hydroxy-propyl)-[2-[(6-hydroxy-6-keto-hexanoyl)amino]ethyl]ammonium Formula: C13H27ClN3O4+ MolecularWeight: 324.82418

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)O)CC(=O)NCC[NH+](CCN)CC(CCl)O

Isomeric SMILES

C(CCC(=O)O)CC(=O)NCC[NH+](CCN)CC(CCl)O

InChI

InChI=1S/C13H26ClN3O4/c14-9-11(18)10-17(7-5-15)8-6-16-12(19)3-1-2-4-13(20)21/h11,18H,1-10,15H2,(H,16,19)(H,20,21)/p+1