[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-(4-pyridylmethyl)ammonium CAS Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-(4-pyridylmethyl)ammonium Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH2+]CC2=CC=NC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)[NH2+]CC2=CC=NC=C2

InChI

InChI=1S/C12H17N3O/c1-9(12(16)15-11-2-3-11)14-8-10-4-6-13-7-5-10/h4-7,9,11,14H,2-3,8H2,1H3,(H,15,16)/p+1/t9-/m0/s1