1-(5-fluoranyl-1H-indol-3-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-(5-fluoranyl-1H-indol-3-yl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazin-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone CAS Name: 1-(5-fluoro-1H-indol-3-yl)-2-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-benzylpiperazin-1-yl)-1-(5-fluoro-1H-indol-3-yl)ethanone Traditional Name: 2-(4-benzylpiperazino)-1-(5-fluoro-1H-indol-3-yl)ethanone Formula: C21H22FN3O MolecularWeight: 351.417283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(=O)C3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H22FN3O/c22-17-6-7-20-18(12-17)19(13-23-20)21(26)15-25-10-8-24(9-11-25)14-16-4-2-1-3-5-16/h1-7,12-13,23H,8-11,14-15H2