methyl 1-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-keto-ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C23H33N2O4+ MolecularWeight: 401.51912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=O)C[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C23H32N2O4/c1-6-29-18-7-8-20-19(13-18)16(2)14-23(3,4)25(20)21(26)15-24-11-9-17(10-12-24)22(27)28-5/h7-8,13-14,17H,6,9-12,15H2,1-5H3/p+1