(2-methyl-2,3-dihydro-1H-benzo[f]isoindol-2-ium-4-yl)methyl ethanoate

Systemtic Name: (2-methyl-2,3-dihydro-1H-benzo[f]isoindol-2-ium-4-yl)methyl ethanoate Openeye Name: (2-methyl-2,3-dihydro-1H-benzo[f]isoindol-2-ium-4-yl)methyl acetate CAS Name: acetic acid (2-methyl-2,3-dihydro-1H-benzo[f]isoindol-2-ium-4-yl)methyl ester IUPAC Name: (2-methyl-2,3-dihydro-1H-benzo[f]isoindol-2-ium-4-yl)methyl acetate Traditional Name: acetic acid (2-methyl-2,3-dihydro-1H-benz[f]isoindol-2-ium-4-yl)methyl ester Formula: C16H18NO2+ MolecularWeight: 256.31962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C2C[NH+](CC2=CC3=CC=CC=C31)C

Isomeric SMILES

CC(=O)OCC1=C2C[NH+](CC2=CC3=CC=CC=C31)C

InChI

InChI=1S/C16H17NO2/c1-11(18)19-10-16-14-6-4-3-5-12(14)7-13-8-17(2)9-15(13)16/h3-7H,8-10H2,1-2H3/p+1