2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone Openeye Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone CAS Name: 2-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone Traditional Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone Formula: C22H24Cl2N3O+ MolecularWeight: 417.35146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2)C)C(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2)C)C(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H23Cl2N3O/c1-14-3-5-17-20(11-14)25-15(2)22(17)21(28)13-26-7-9-27(10-8-26)16-4-6-18(23)19(24)12-16/h3-6,11-12,25H,7-10,13H2,1-2H3/p+1