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

Systemtic Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-quinolin-1-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolinyl)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(6-ethoxy-2,2,4-trimethylquinolin-1-yl)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(6-ethoxy-2,2,4-trimethyl-1-quinolyl)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O3/c1-5-28-17-6-7-19-18(12-17)15(2)13-22(3,4)25(19)20(26)14-24-10-8-16(9-11-24)21(23)27/h6-7,12-13,16H,5,8-11,14H2,1-4H3,(H2,23,27)/p+1