ethyl 6-bromanyl-4-(2-hydroxyethylamino)quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-(2-hydroxyethylamino)quinolin-1-ium-3-carboxylate Openeye Name: ethyl 6-bromo-4-(2-hydroxyethylamino)quinolin-1-ium-3-carboxylate CAS Name: 6-bromo-4-(2-hydroxyethylamino)-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-(2-hydroxyethylamino)quinolin-1-ium-3-carboxylate Traditional Name: 6-bromo-4-(2-hydroxyethylamino)quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C14H16BrN2O3+ MolecularWeight: 340.19244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCCO)Br

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCCO)Br

InChI

InChI=1S/C14H15BrN2O3/c1-2-20-14(19)11-8-17-12-4-3-9(15)7-10(12)13(11)16-5-6-18/h3-4,7-8,18H,2,5-6H2,1H3,(H,16,17)/p+1