1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(3-chlorophenyl)-4-(4-methoxyphenyl)sulfonyl-piperazin-1-ium Formula: C17H20ClN2O3S+ MolecularWeight: 367.8703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H19ClN2O3S/c1-23-16-5-7-17(8-6-16)24(21,22)20-11-9-19(10-12-20)15-4-2-3-14(18)13-15/h2-8,13H,9-12H2,1H3/p+1