2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)N4CCC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)N4CCC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N4O/c29-24(28-15-12-22(26-28)19-6-2-1-3-7-19)17-27-13-10-18(11-14-27)21-16-25-23-9-5-4-8-20(21)23/h1-9,16,18,25H,10-15,17H2/p+1