O3-ethyl O8-methyl 4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinoline-3,8-dicarboxylate

Systemtic Name: O3-ethyl O8-methyl 4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinoline-3,8-dicarboxylate Openeye Name: O3-ethyl O8-methyl 4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinoline-3,8-dicarboxylate CAS Name: 4-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)amino]quinoline-3,8-dicarboxylic acid O3-ethyl ester O8-methyl ester IUPAC Name: 3-O-ethyl 8-O-methyl 4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinoline-3,8-dicarboxylate Traditional Name: 4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinoline-3,8-dicarboxylic acid O3-ethyl ester O8-methyl ester Formula: C23H32N3O4+ MolecularWeight: 414.51788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3CC([NH2+]C(C3)(C)C)(C)C)C=CC=C2C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3CC([NH2+]C(C3)(C)C)(C)C)C=CC=C2C(=O)OC

InChI

InChI=1S/C23H31N3O4/c1-7-30-21(28)17-13-24-18-15(9-8-10-16(18)20(27)29-6)19(17)25-14-11-22(2,3)26-23(4,5)12-14/h8-10,13-14,26H,7,11-12H2,1-6H3,(H,24,25)/p+1