1-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-4-(diphenylmethyl)piperazin-4-ium

Systemtic Name: 1-[3,4-bis(chloranyl)-2-methoxy-phenyl]sulfonyl-4-(diphenylmethyl)piperazin-4-ium Openeye Name: 1-benzhydryl-4-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(3,4-dichloro-2-methoxyphenyl)sulfonyl-4-(diphenylmethyl)piperazin-4-ium IUPAC Name: 1-benzhydryl-4-(3,4-dichloro-2-methoxyphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-benzhydryl-4-(3,4-dichloro-2-methoxy-phenyl)sulfonyl-piperazin-1-ium Formula: C24H25Cl2N2O3S+ MolecularWeight: 492.4379

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1Cl)Cl)S(=O)(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1Cl)Cl)S(=O)(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H24Cl2N2O3S/c1-31-24-21(13-12-20(25)22(24)26)32(29,30)28-16-14-27(15-17-28)23(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-13,23H,14-17H2,1H3/p+1