[3-[aminomethyl-[(6-oxidanylidenehexanoylamino)methyl]amino]-2-oxidanyl-propyl]-(hydroxymethyl)-dimethyl-azanium

Systemtic Name: [3-[aminomethyl-[(6-oxidanylidenehexanoylamino)methyl]amino]-2-oxidanyl-propyl]-(hydroxymethyl)-dimethyl-azanium Openeye Name: [3-[aminomethyl-[(6-oxohexanoylamino)methyl]amino]-2-hydroxy-propyl]-(hydroxymethyl)-dimethyl-ammonium CAS Name: [3-[aminomethyl-[(1,6-dioxohexylamino)methyl]amino]-2-hydroxypropyl]-(hydroxymethyl)-dimethylammonium IUPAC Name: [3-[aminomethyl-[(6-oxohexanoylamino)methyl]amino]-2-hydroxypropyl]-(hydroxymethyl)-dimethylazanium Traditional Name: [3-[aminomethyl-[(6-ketohexanoylamino)methyl]amino]-2-hydroxy-propyl]-dimethyl-methylol-ammonium Formula: C14H31N4O4+ MolecularWeight: 319.42034

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(CN(CN)CNC(=O)CCCCC=O)O)CO

Isomeric SMILES

C[N+](C)(CC(CN(CN)CNC(=O)CCCCC=O)O)CO

InChI

InChI=1S/C14H30N4O4/c1-18(2,12-20)9-13(21)8-17(10-15)11-16-14(22)6-4-3-5-7-19/h7,13,20-21H,3-6,8-12,15H2,1-2H3/p+1