1-(4-ethoxy-2-methoxy-phenyl)carbonyl-5,7-bis(fluoranyl)-1-piperidin-4-yl-quinolin-1-ium-2-one

Systemtic Name: 1-(4-ethoxy-2-methoxy-phenyl)carbonyl-5,7-bis(fluoranyl)-1-piperidin-4-yl-quinolin-1-ium-2-one Openeye Name: 1-(4-ethoxy-2-methoxy-benzoyl)-5,7-difluoro-1-(4-piperidyl)quinolin-1-ium-2-one CAS Name: 1-[(4-ethoxy-2-methoxyphenyl)-oxomethyl]-5,7-difluoro-1-(4-piperidinyl)-2-quinolin-1-iumone IUPAC Name: 1-(4-ethoxy-2-methoxybenzoyl)-5,7-difluoro-1-piperidin-4-ylquinolin-1-ium-2-one Traditional Name: 1-(4-ethoxy-2-methoxy-benzoyl)-5,7-difluoro-1-(4-piperidyl)quinolin-1-ium-2-one Formula: C24H25F2N2O4+ MolecularWeight: 443.463106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)[N+]2(C(=O)C=CC3=C(C=C(C=C32)F)F)C4CCNCC4)OC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)[N+]2(C(=O)C=CC3=C(C=C(C=C32)F)F)C4CCNCC4)OC

InChI

InChI=1S/C24H25F2N2O4/c1-3-32-17-4-5-19(22(14-17)31-2)24(30)28(16-8-10-27-11-9-16)21-13-15(25)12-20(26)18(21)6-7-23(28)29/h4-7,12-14,16,27H,3,8-11H2,1-2H3/q+1