2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone

Systemtic Name: 2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Openeye Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone CAS Name: 2-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]-1-(5-methoxy-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Traditional Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(=O)C3=CNC4=C3C=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(=O)C3=CNC4=C3C=C(C=C4)OC

InChI

InChI=1S/C22H24ClN3O2/c1-15-3-4-16(23)11-21(15)26-9-7-25(8-10-26)14-22(27)19-13-24-20-6-5-17(28-2)12-18(19)20/h3-6,11-13,24H,7-10,14H2,1-2H3/p+1