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

Systemtic Name: [(2S)-1-oxidanylidene-1-(pentylamino)propan-2-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(1S)-1-methyl-2-oxo-2-(pentylamino)ethyl]-(4-pyridylmethyl)ammonium CAS Name: [(2S)-1-oxo-1-(pentylamino)propan-2-yl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(2S)-1-oxo-1-(pentylamino)propan-2-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(1S)-2-(amylamino)-2-keto-1-methyl-ethyl]-(4-pyridylmethyl)ammonium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)[NH2+]CC1=CC=NC=C1

Isomeric SMILES

CCCCCNC(=O)[C@H](C)[NH2+]CC1=CC=NC=C1

InChI

InChI=1S/C14H23N3O/c1-3-4-5-8-16-14(18)12(2)17-11-13-6-9-15-10-7-13/h6-7,9-10,12,17H,3-5,8,11H2,1-2H3,(H,16,18)/p+1/t12-/m0/s1