7-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]carbonyl-1H-indol-1-ium-3-carbonitrile chloride

Systemtic Name: 7-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]carbonyl-1H-indol-1-ium-3-carbonitrile chloride Openeye Name: 7-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indol-1-ium-3-carbonitrile chloride CAS Name: 7-[[4-[2-(4-fluorophenyl)ethyl]-1-piperazinyl]-oxomethyl]-1H-indol-1-ium-3-carbonitrile chloride IUPAC Name: 7-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indol-1-ium-3-carbonitrile chloride Traditional Name: 7-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indol-1-ium-3-carbonitrile chloride Formula: C22H22ClFN4O MolecularWeight: 412.887683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)F)C(=O)C3=CC=CC4=C3[NH2+]C=C4C#N.[Cl-]

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)F)C(=O)C3=CC=CC4=C3[NH2+]C=C4C#N.[Cl-]

InChI

InChI=1S/C22H21FN4O.ClH/c23-18-6-4-16(5-7-18)8-9-26-10-12-27(13-11-26)22(28)20-3-1-2-19-17(14-24)15-25-21(19)20;/h1-7,15,25H,8-13H2;1H