1-(4-fluorophenyl)-1-[2-(2-oxidanylideneimidazolidin-1-yl)ethyl]-3-piperidin-4-yl-indol-1-ium-6-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-1-[2-(2-oxidanylideneimidazolidin-1-yl)ethyl]-3-piperidin-4-yl-indol-1-ium-6-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-(4-piperidyl)indol-1-ium-6-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[2-(2-oxo-1-imidazolidinyl)ethyl]-3-(4-piperidinyl)-6-indol-1-iumcarbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-piperidin-4-ylindol-1-ium-6-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-[2-(2-ketoimidazolidin-1-yl)ethyl]-3-(4-piperidyl)indol-1-ium-6-carbonitrile Formula: C25H27FN5O+ MolecularWeight: 432.513183

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C[N+](C3=C2C=CC(=C3)C#N)(CCN4CCNC4=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CNCCC1C2=C[N+](C3=C2C=CC(=C3)C#N)(CCN4CCNC4=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H26FN5O/c26-20-2-4-21(5-3-20)31(14-13-30-12-11-29-25(30)32)17-23(19-7-9-28-10-8-19)22-6-1-18(16-27)15-24(22)31/h1-6,15,17,19,28H,7-14H2/p+1