[4-[[3-(phenylmethyl)imidazol-3-ium-1-yl]methyl]phenyl] ethanoate

Systemtic Name: [4-[[3-(phenylmethyl)imidazol-3-ium-1-yl]methyl]phenyl] ethanoate Openeye Name: [4-[(3-benzylimidazol-3-ium-1-yl)methyl]phenyl] acetate CAS Name: acetic acid [4-[[3-(phenylmethyl)-1-imidazol-3-iumyl]methyl]phenyl] ester IUPAC Name: [4-[(3-benzylimidazol-3-ium-1-yl)methyl]phenyl] acetate Traditional Name: acetic acid [4-[(3-benzylimidazol-3-ium-1-yl)methyl]phenyl] ester Formula: C19H19N2O2+ MolecularWeight: 307.36636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)CN2C=C[N+](=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)CN2C=C[N+](=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H19N2O2/c1-16(22)23-19-9-7-18(8-10-19)14-21-12-11-20(15-21)13-17-5-3-2-4-6-17/h2-12,15H,13-14H2,1H3/q+1