[(2S)-butan-2-yl]-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[2-(pyridine-3-carbonylamino)ethyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-[[oxo(3-pyridinyl)methyl]amino]ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-(pyridine-3-carbonylamino)ethyl]azanium Traditional Name: [(1S)-1-methylpropyl]-(2-nicotinamidoethyl)ammonium Formula: C12H20N3O+ MolecularWeight: 222.3067

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCNC(=O)C1=CN=CC=C1

Isomeric SMILES

CC[C@H](C)[NH2+]CCNC(=O)C1=CN=CC=C1

InChI

InChI=1S/C12H19N3O/c1-3-10(2)14-7-8-15-12(16)11-5-4-6-13-9-11/h4-6,9-10,14H,3,7-8H2,1-2H3,(H,15,16)/p+1/t10-/m0/s1