methyl 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylate

Systemtic Name: methyl 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylate Openeye Name: methyl 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylate CAS Name: 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylate Traditional Name: 3-(1-phenylethyl)-3-azoniabicyclo[2.2.1]hept-3-ene-2-carboxylic acid methyl ester Formula: C16H20NO2+ MolecularWeight: 258.3355

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=C3CCC(C3)C2C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)[N+]2=C3CCC(C3)C2C(=O)OC

InChI

InChI=1S/C16H20NO2/c1-11(12-6-4-3-5-7-12)17-14-9-8-13(10-14)15(17)16(18)19-2/h3-7,11,13,15H,8-10H2,1-2H3/q+1