methyl 4-[(3-ethoxycarbonylphenyl)amino]-2-methyl-quinolin-1-ium-6-carboxylate

Systemtic Name: methyl 4-[(3-ethoxycarbonylphenyl)amino]-2-methyl-quinolin-1-ium-6-carboxylate Openeye Name: methyl 4-(3-ethoxycarbonylanilino)-2-methyl-quinolin-1-ium-6-carboxylate CAS Name: 4-(3-ethoxycarbonylanilino)-2-methyl-6-quinolin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 4-(3-ethoxycarbonylanilino)-2-methylquinolin-1-ium-6-carboxylate Traditional Name: 4-(3-carbethoxyanilino)-2-methyl-quinolin-1-ium-6-carboxylic acid methyl ester Formula: C21H21N2O4+ MolecularWeight: 365.40244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=CC(=[NH+]C3=C2C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C21H20N2O4/c1-4-27-21(25)14-6-5-7-16(11-14)23-19-10-13(2)22-18-9-8-15(12-17(18)19)20(24)26-3/h5-12H,4H2,1-3H3,(H,22,23)/p+1