[1-[(2S)-butan-2-yl]pyrazol-4-yl]methyl-(2-hydroxyethyl)azanium

Systemtic Name: [1-[(2S)-butan-2-yl]pyrazol-4-yl]methyl-(2-hydroxyethyl)azanium Openeye Name: 2-hydroxyethyl-[[1-[(1S)-1-methylpropyl]pyrazol-4-yl]methyl]ammonium CAS Name: [1-[(2S)-butan-2-yl]-4-pyrazolyl]methyl-(2-hydroxyethyl)ammonium IUPAC Name: [1-[(2S)-butan-2-yl]pyrazol-4-yl]methyl-(2-hydroxyethyl)azanium Traditional Name: 2-hydroxyethyl-[[1-[(1S)-1-methylpropyl]pyrazol-4-yl]methyl]ammonium Formula: C10H20N3O+ MolecularWeight: 198.2853

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C=N1)C[NH2+]CCO

Isomeric SMILES

CC[C@H](C)N1C=C(C=N1)C[NH2+]CCO

InChI

InChI=1S/C10H19N3O/c1-3-9(2)13-8-10(7-12-13)6-11-4-5-14/h7-9,11,14H,3-6H2,1-2H3/p+1/t9-/m0/s1