1-(5-chloranyl-2-methoxy-phenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(5-chloro-2-methoxyphenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(5-chloro-2-methoxyphenyl)sulfonyl-4-[(3-methoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-m-anisyl-piperazin-4-ium Formula: C19H24ClN2O4S+ MolecularWeight: 411.92286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H23ClN2O4S/c1-25-17-5-3-4-15(12-17)14-21-8-10-22(11-9-21)27(23,24)19-13-16(20)6-7-18(19)26-2/h3-7,12-13H,8-11,14H2,1-2H3/p+1