N-[2-methoxy-4-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]sulfonyl-phenyl]ethanamide

Systemtic Name: N-[2-methoxy-4-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]sulfonyl-phenyl]ethanamide Openeye Name: N-[2-methoxy-4-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]sulfonyl-phenyl]acetamide CAS Name: N-[2-methoxy-4-[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[2-methoxy-4-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[2-methoxy-4-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]sulfonyl-phenyl]acetamide Formula: C24H28N3O4S+ MolecularWeight: 454.56182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C24H27N3O4S/c1-18(28)25-23-11-10-21(16-24(23)31-2)32(29,30)27-14-12-26(13-15-27)17-20-8-5-7-19-6-3-4-9-22(19)20/h3-11,16H,12-15,17H2,1-2H3,(H,25,28)/p+1