1-(4-ethoxy-3-propan-2-yl-phenyl)sulfonyl-4-methyl-piperazin-4-ium

Systemtic Name: 1-(4-ethoxy-3-propan-2-yl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Openeye Name: 1-(4-ethoxy-3-isopropyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium CAS Name: 1-(4-ethoxy-3-propan-2-ylphenyl)sulfonyl-4-methylpiperazin-4-ium IUPAC Name: 1-(4-ethoxy-3-propan-2-ylphenyl)sulfonyl-4-methylpiperazin-4-ium Traditional Name: 1-(4-ethoxy-3-isopropyl-phenyl)sulfonyl-4-methyl-piperazin-4-ium Formula: C16H27N2O3S+ MolecularWeight: 327.46218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C)C(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C)C(C)C

InChI

InChI=1S/C16H26N2O3S/c1-5-21-16-7-6-14(12-15(16)13(2)3)22(19,20)18-10-8-17(4)9-11-18/h6-7,12-13H,5,8-11H2,1-4H3/p+1