2-[4-(4-butoxynaphthalen-1-yl)sulfonylpiperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(4-butoxynaphthalen-1-yl)sulfonylpiperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-[(4-butoxy-1-naphthyl)sulfonyl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[(4-butoxy-1-naphthalenyl)sulfonyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(4-butoxynaphthalen-1-yl)sulfonylpiperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-[(4-butoxy-1-naphthyl)sulfonyl]piperazin-1-ium-1-yl]ethanol Formula: C20H29N2O4S+ MolecularWeight: 393.52026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3CC[NH+](CC3)CCO

Isomeric SMILES

CCCCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3CC[NH+](CC3)CCO

InChI

InChI=1S/C20H28N2O4S/c1-2-3-16-26-19-8-9-20(18-7-5-4-6-17(18)19)27(24,25)22-12-10-21(11-13-22)14-15-23/h4-9,23H,2-3,10-16H2,1H3/p+1