methyl isoquinolin-2-ium-4-carboxylate

Systemtic Name: methyl isoquinolin-2-ium-4-carboxylate Openeye Name: methyl isoquinolin-2-ium-4-carboxylate CAS Name: 4-isoquinolin-2-iumcarboxylic acid methyl ester IUPAC Name: methyl isoquinolin-2-ium-4-carboxylate Traditional Name: isoquinolin-2-ium-4-carboxylic acid methyl ester Formula: C11H10NO2+ MolecularWeight: 188.2026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C[NH+]=CC2=CC=CC=C21

Isomeric SMILES

COC(=O)C1=C[NH+]=CC2=CC=CC=C21

InChI

InChI=1S/C11H9NO2/c1-14-11(13)10-7-12-6-8-4-2-3-5-9(8)10/h2-7H,1H3/p+1