ethyl 4-[(2,4-dimethylphenyl)amino]-2-methyl-quinolin-1-ium-6-carboxylate

Systemtic Name: ethyl 4-[(2,4-dimethylphenyl)amino]-2-methyl-quinolin-1-ium-6-carboxylate Openeye Name: ethyl 4-(2,4-dimethylanilino)-2-methyl-quinolin-1-ium-6-carboxylate CAS Name: 4-(2,4-dimethylanilino)-2-methyl-6-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dimethylanilino)-2-methylquinolin-1-ium-6-carboxylate Traditional Name: 4-(2,4-dimethylanilino)-2-methyl-quinolin-1-ium-6-carboxylic acid ethyl ester Formula: C21H23N2O2+ MolecularWeight: 335.41952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)[NH+]=C(C=C2NC3=C(C=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)[NH+]=C(C=C2NC3=C(C=C(C=C3)C)C)C

InChI

InChI=1S/C21H22N2O2/c1-5-25-21(24)16-7-9-19-17(12-16)20(11-15(4)22-19)23-18-8-6-13(2)10-14(18)3/h6-12H,5H2,1-4H3,(H,22,23)/p+1