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

Systemtic Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[4-(3,4-dichlorophenyl)-1-piperazin-1-iumyl]-1-(2-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[4-(3,4-dichlorophenyl)piperazin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Formula: C21H22Cl2N3O+ MolecularWeight: 403.32488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O/c1-14-21(16-4-2-3-5-19(16)24-14)20(27)13-25-8-10-26(11-9-25)15-6-7-17(22)18(23)12-15/h2-7,12,24H,8-11,13H2,1H3/p+1