ethyl 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate

Systemtic Name: ethyl 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate Openeye Name: ethyl 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate CAS Name: 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate Traditional Name: 2-ethyl-3,4-dihydroisoquinolin-2-ium-1-carboxylic acid ethyl ester Formula: C14H18NO2+ MolecularWeight: 232.29822

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C2=CC=CC=C2CC1)C(=O)OCC

Isomeric SMILES

CC[N+]1=C(C2=CC=CC=C2CC1)C(=O)OCC

InChI

InChI=1S/C14H18NO2/c1-3-15-10-9-11-7-5-6-8-12(11)13(15)14(16)17-4-2/h5-8H,3-4,9-10H2,1-2H3/q+1