2-(2-pyridin-1-ium-1-ylethanoylamino)ethyl propanoate

Systemtic Name: 2-(2-pyridin-1-ium-1-ylethanoylamino)ethyl propanoate Openeye Name: 2-[(2-pyridin-1-ium-1-ylacetyl)amino]ethyl propanoate CAS Name: propanoic acid 2-[[1-oxo-2-(1-pyridin-1-iumyl)ethyl]amino]ethyl ester IUPAC Name: 2-[(2-pyridin-1-ium-1-ylacetyl)amino]ethyl propanoate Traditional Name: propionic acid 2-[(2-pyridin-1-ium-1-ylacetyl)amino]ethyl ester Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCCNC(=O)C[N+]1=CC=CC=C1

Isomeric SMILES

CCC(=O)OCCNC(=O)C[N+]1=CC=CC=C1

InChI

InChI=1S/C12H16N2O3/c1-2-12(16)17-9-6-13-11(15)10-14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-10H2,1H3/p+1