ethyl 6-methoxy-4-(pyridin-3-ylmethylamino)quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 6-methoxy-4-(pyridin-3-ylmethylamino)quinolin-1-ium-3-carboxylate Openeye Name: ethyl 6-methoxy-4-(3-pyridylmethylamino)quinolin-1-ium-3-carboxylate CAS Name: 6-methoxy-4-(3-pyridinylmethylamino)-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 6-methoxy-4-(pyridin-3-ylmethylamino)quinolin-1-ium-3-carboxylate Traditional Name: 6-methoxy-4-(3-pyridylmethylamino)quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCC3=CN=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCC3=CN=CC=C3)OC

InChI

InChI=1S/C19H19N3O3/c1-3-25-19(23)16-12-21-17-7-6-14(24-2)9-15(17)18(16)22-11-13-5-4-8-20-10-13/h4-10,12H,3,11H2,1-2H3,(H,21,22)/p+1