N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonylethyl]naphthalene-1-carboxamide

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]sulfonylethyl]naphthalene-1-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)sulfonylethyl]naphthalene-1-carboxamide CAS Name: N-[2-[[4-(phenylmethyl)-1-piperazin-4-iumyl]sulfonyl]ethyl]-1-naphthalenecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)sulfonylethyl]naphthalene-1-carboxamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)sulfonylethyl]-1-naphthamide Formula: C24H28N3O3S+ MolecularWeight: 438.56242

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)CCNC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)S(=O)(=O)CCNC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H27N3O3S/c28-24(23-12-6-10-21-9-4-5-11-22(21)23)25-13-18-31(29,30)27-16-14-26(15-17-27)19-20-7-2-1-3-8-20/h1-12H,13-19H2,(H,25,28)/p+1