2-[4-(3-methyl-4-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(3-methyl-4-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(3-methyl-4-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(3-methyl-4-propoxyphenyl)sulfonyl-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(3-methyl-4-propoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(3-methyl-4-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Formula: C16H27N2O4S+ MolecularWeight: 343.46158

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCO)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CCO)C

InChI

InChI=1S/C16H26N2O4S/c1-3-12-22-16-5-4-15(13-14(16)2)23(20,21)18-8-6-17(7-9-18)10-11-19/h4-5,13,19H,3,6-12H2,1-2H3/p+1