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

Systemtic Name: 2-[4-(4-bromanyl-3-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(4-bromo-3-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(4-bromo-3-propoxyphenyl)sulfonyl-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(4-bromo-3-propoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(4-bromo-3-propoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanol Formula: C15H24BrN2O4S+ MolecularWeight: 408.33106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23BrN2O4S/c1-2-11-22-15-12-13(3-4-14(15)16)23(20,21)18-7-5-17(6-8-18)9-10-19/h3-4,12,19H,2,5-11H2,1H3/p+1