1-[[1-[2,3-bis(chloranyl)phenyl]pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[[1-[2,3-bis(chloranyl)phenyl]pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[[1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium CAS Name: 1-[[1-(2,3-dichlorophenyl)-2-pyrrolyl]methyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[[1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl]-4-methylpiperazin-4-ium Traditional Name: 1-[[1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl]-4-methyl-piperazin-4-ium Formula: C16H20Cl2N3+ MolecularWeight: 325.2561

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=CN2C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=CN2C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C16H19Cl2N3/c1-19-8-10-20(11-9-19)12-13-4-3-7-21(13)15-6-2-5-14(17)16(15)18/h2-7H,8-12H2,1H3/p+1