2-[2-[methyl(2-pyridin-4-ylethyl)azaniumyl]ethanoylamino]ethanoate

Systemtic Name: 2-[2-[methyl(2-pyridin-4-ylethyl)azaniumyl]ethanoylamino]ethanoate Openeye Name: 2-[[2-[methyl-[2-(4-pyridyl)ethyl]ammonio]acetyl]amino]acetate CAS Name: 2-[[2-[methyl(2-pyridin-4-ylethyl)ammonio]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[methyl(2-pyridin-4-ylethyl)azaniumyl]acetyl]amino]acetate Traditional Name: 2-[[2-[methyl-[2-(4-pyridyl)ethyl]ammonio]acetyl]amino]acetate Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=NC=C1)CC(=O)NCC(=O)[O-]

Isomeric SMILES

C[NH+](CCC1=CC=NC=C1)CC(=O)NCC(=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-15(9-11(16)14-8-12(17)18)7-4-10-2-5-13-6-3-10/h2-3,5-6H,4,7-9H2,1H3,(H,14,16)(H,17,18)