[(2S)-1-(3-imidazol-1-ylpropylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-(3-imidazol-1-ylpropylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[3-(1-imidazolyl)propylamino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(3-imidazol-1-ylpropylamino)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C9H17N4O+ MolecularWeight: 197.25748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCN1C=CN=C1)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCCN1C=CN=C1)[NH3+]

InChI

InChI=1S/C9H16N4O/c1-8(10)9(14)12-3-2-5-13-6-4-11-7-13/h4,6-8H,2-3,5,10H2,1H3,(H,12,14)/p+1/t8-/m0/s1