1-(4-methoxynaphthalen-1-yl)sulfonyl-4-(phenylmethyl)piperazin-4-ium

Systemtic Name: 1-(4-methoxynaphthalen-1-yl)sulfonyl-4-(phenylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-[(4-methoxy-1-naphthyl)sulfonyl]piperazin-1-ium CAS Name: 1-[(4-methoxy-1-naphthalenyl)sulfonyl]-4-(phenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-(4-methoxynaphthalen-1-yl)sulfonylpiperazin-1-ium Traditional Name: 1-benzyl-4-[(4-methoxy-1-naphthyl)sulfonyl]piperazin-1-ium Formula: C22H25N2O3S+ MolecularWeight: 397.5105

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3S/c1-27-21-11-12-22(20-10-6-5-9-19(20)21)28(25,26)24-15-13-23(14-16-24)17-18-7-3-2-4-8-18/h2-12H,13-17H2,1H3/p+1