2-pyridin-1-ium-1-ylethyl 3-pyridin-1-ium-1-ylpropanoate

Systemtic Name: 2-pyridin-1-ium-1-ylethyl 3-pyridin-1-ium-1-ylpropanoate Openeye Name: 2-pyridin-1-ium-1-ylethyl 3-pyridin-1-ium-1-ylpropanoate CAS Name: 3-(1-pyridin-1-iumyl)propanoic acid 2-(1-pyridin-1-iumyl)ethyl ester IUPAC Name: 2-pyridin-1-ium-1-ylethyl 3-pyridin-1-ium-1-ylpropanoate Traditional Name: 3-pyridin-1-ium-1-ylpropionic acid 2-pyridin-1-ium-1-ylethyl ester Formula: C15H18N2O2+2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCC(=O)OCC[N+]2=CC=CC=C2

Isomeric SMILES

C1=CC=[N+](C=C1)CCC(=O)OCC[N+]2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2/c18-15(7-12-16-8-3-1-4-9-16)19-14-13-17-10-5-2-6-11-17/h1-6,8-11H,7,12-14H2/q+2