ethyl 6-ethoxy-4-(furan-2-ylmethylamino)quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 6-ethoxy-4-(furan-2-ylmethylamino)quinolin-1-ium-3-carboxylate Openeye Name: ethyl 6-ethoxy-4-(2-furylmethylamino)quinolin-1-ium-3-carboxylate CAS Name: 6-ethoxy-4-(2-furanylmethylamino)-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 6-ethoxy-4-(furan-2-ylmethylamino)quinolin-1-ium-3-carboxylate Traditional Name: 6-ethoxy-4-(2-furfurylamino)quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C19H21N2O4+ MolecularWeight: 341.38104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=C[NH+]=C2C=C1)C(=O)OCC)NCC3=CC=CO3

Isomeric SMILES

CCOC1=CC2=C(C(=C[NH+]=C2C=C1)C(=O)OCC)NCC3=CC=CO3

InChI

InChI=1S/C19H20N2O4/c1-3-23-13-7-8-17-15(10-13)18(21-11-14-6-5-9-25-14)16(12-20-17)19(22)24-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,20,21)/p+1