1H-indol-3-yl-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone

Systemtic Name: 1H-indol-3-yl-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone Openeye Name: 1H-indol-3-yl-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)-1-piperidyl]methanone CAS Name: 1H-indol-3-yl-[(3S)-3-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinyl]methanone IUPAC Name: 1H-indol-3-yl-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]methanone Traditional Name: 1H-indol-3-yl-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidino]methanone Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CNC3=CC=CC=C32)[NH+]4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CNC3=CC=CC=C32)[NH+]4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H28N4O/c29-24(22-17-25-23-11-5-4-10-21(22)23)28-12-6-9-20(18-28)27-15-13-26(14-16-27)19-7-2-1-3-8-19/h1-5,7-8,10-11,17,20,25H,6,9,12-16,18H2/p+1/t20-/m0/s1