[(2S)-1-oxidanylidene-1-[[5-(5-oxidanylpentylamino)pyridin-2-yl]amino]propan-2-yl]azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-[[5-(5-oxidanylpentylamino)pyridin-2-yl]amino]propan-2-yl]azanium Openeye Name: [(1S)-2-[[5-(5-hydroxypentylamino)-2-pyridyl]amino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[5-(5-hydroxypentylamino)-2-pyridinyl]amino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[[5-(5-hydroxypentylamino)pyridin-2-yl]amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[[5-(5-hydroxypentylamino)-2-pyridyl]amino]-2-keto-1-methyl-ethyl]ammonium Formula: C13H23N4O2+ MolecularWeight: 267.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)NCCCCCO)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=C(C=C1)NCCCCCO)[NH3+]

InChI

InChI=1S/C13H22N4O2/c1-10(14)13(19)17-12-6-5-11(9-16-12)15-7-3-2-4-8-18/h5-6,9-10,15,18H,2-4,7-8,14H2,1H3,(H,16,17,19)/p+1/t10-/m0/s1