ethyl 8-ethyl-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinolin-1-ium-3-carboxylate

Systemtic Name: ethyl 8-ethyl-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinolin-1-ium-3-carboxylate Openeye Name: ethyl 8-ethyl-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinolin-1-ium-3-carboxylate CAS Name: 8-ethyl-4-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)amino]-3-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 8-ethyl-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinolin-1-ium-3-carboxylate Traditional Name: 8-ethyl-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]quinolin-1-ium-3-carboxylic acid ethyl ester Formula: C23H35N3O2+2 MolecularWeight: 385.5429

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=C[NH+]=C21)C(=O)OCC)NC3CC([NH2+]C(C3)(C)C)(C)C

Isomeric SMILES

CCC1=CC=CC2=C(C(=C[NH+]=C21)C(=O)OCC)NC3CC([NH2+]C(C3)(C)C)(C)C

InChI

InChI=1S/C23H33N3O2/c1-7-15-10-9-11-17-19(15)24-14-18(21(27)28-8-2)20(17)25-16-12-22(3,4)26-23(5,6)13-16/h9-11,14,16,26H,7-8,12-13H2,1-6H3,(H,24,25)/p+2