[(2S,3S)-3-methyl-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-[methyl-[2-(4-pyridyl)ethyl]carbamoyl]butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-[methyl-[2-(4-pyridyl)ethyl]carbamoyl]butyl]ammonium Formula: C14H24N3O+ MolecularWeight: 250.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(C)CCC1=CC=NC=C1)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N(C)CCC1=CC=NC=C1)[NH3+]

InChI

InChI=1S/C14H23N3O/c1-4-11(2)13(15)14(18)17(3)10-7-12-5-8-16-9-6-12/h5-6,8-9,11,13H,4,7,10,15H2,1-3H3/p+1/t11-,13-/m0/s1