2-ethyl-1-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-1-methyl-2H-indol-1-ium-3-one

Systemtic Name: 2-ethyl-1-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]-1-methyl-2H-indol-1-ium-3-one Openeye Name: 2-ethyl-1-[4-(4-fluorobenzoyl)-1-piperidyl]-1-methyl-indolin-1-ium-3-one CAS Name: 2-ethyl-1-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-1-methyl-2H-indol-1-ium-3-one IUPAC Name: 2-ethyl-1-[4-(4-fluorobenzoyl)piperidin-1-yl]-1-methyl-2H-indol-1-ium-3-one Traditional Name: 2-ethyl-1-[4-(4-fluorobenzoyl)piperidino]-1-methyl-indolin-1-ium-3-one Formula: C23H26FN2O2+ MolecularWeight: 381.463143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)C2=CC=CC=C2[N+]1(C)N3CCC(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1C(=O)C2=CC=CC=C2[N+]1(C)N3CCC(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN2O2/c1-3-20-23(28)19-6-4-5-7-21(19)26(20,2)25-14-12-17(13-15-25)22(27)16-8-10-18(24)11-9-16/h4-11,17,20H,3,12-15H2,1-2H3/q+1