4-(5-fluoranyl-1H-indol-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(5-fluoranyl-1H-indol-3-yl)-1-[4-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-4-(5-fluoro-1H-indol-3-yl)butan-1-one CAS Name: 4-(5-fluoro-1H-indol-3-yl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-4-(5-fluoro-1H-indol-3-yl)butan-1-one Traditional Name: 1-(4-benzylpiperazino)-4-(5-fluoro-1H-indol-3-yl)butan-1-one Formula: C23H26FN3O MolecularWeight: 379.470443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCC3=CNC4=C3C=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCCC3=CNC4=C3C=C(C=C4)F

InChI

InChI=1S/C23H26FN3O/c24-20-9-10-22-21(15-20)19(16-25-22)7-4-8-23(28)27-13-11-26(12-14-27)17-18-5-2-1-3-6-18/h1-3,5-6,9-10,15-16,25H,4,7-8,11-14,17H2