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

Systemtic Name: ethyl 2-methyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate Openeye Name: ethyl 2-methyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate CAS Name: 2-methyl-3,4-dihydroisoquinolin-2-ium-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-3,4-dihydroisoquinolin-2-ium-1-carboxylate Traditional Name: 2-methyl-3,4-dihydroisoquinolin-2-ium-1-carboxylic acid ethyl ester Formula: C13H16NO2+ MolecularWeight: 218.27164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+](CCC2=CC=CC=C21)C

Isomeric SMILES

CCOC(=O)C1=[N+](CCC2=CC=CC=C21)C

InChI

InChI=1S/C13H16NO2/c1-3-16-13(15)12-11-7-5-4-6-10(11)8-9-14(12)2/h4-7H,3,8-9H2,1-2H3/q+1