1-[2,5-bis(chloranyl)phenyl]sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(2,5-dichlorophenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(2,5-dichlorophenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2,5-dichlorophenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(2,5-dichlorophenyl)sulfonyl-4-o-anisyl-piperazin-4-ium Formula: C18H21Cl2N2O3S+ MolecularWeight: 416.34194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

COC1=CC=CC=C1C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C18H20Cl2N2O3S/c1-25-17-5-3-2-4-14(17)13-21-8-10-22(11-9-21)26(23,24)18-12-15(19)6-7-16(18)20/h2-7,12H,8-11,13H2,1H3/p+1