[(1-oxidanidylpyridin-1-ium-4-yl)-phenyl-methyl] ethanoate

Systemtic Name: [(1-oxidanidylpyridin-1-ium-4-yl)-phenyl-methyl] ethanoate Openeye Name: [(1-oxidopyridin-1-ium-4-yl)-phenyl-methyl] acetate CAS Name: acetic acid [(1-oxido-4-pyridin-1-iumyl)-phenylmethyl] ester IUPAC Name: [(1-oxidopyridin-1-ium-4-yl)-phenylmethyl] acetate Traditional Name: acetic acid [(1-oxidopyridin-1-ium-4-yl)-phenyl-methyl] ester Formula: C14H13NO3 MolecularWeight: 243.25792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C14H13NO3/c1-11(16)18-14(12-5-3-2-4-6-12)13-7-9-15(17)10-8-13/h2-10,14H,1H3