[3-(methylsulfonylmethyl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [3-(methylsulfonylmethyl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [3-(methylsulfonylmethyl)phenyl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(methylsulfonylmethyl)phenyl]-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [3-(methylsulfonylmethyl)phenyl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [3-(mesylmethyl)phenyl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone Formula: C24H27N2O3S+ MolecularWeight: 423.54778

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H26N2O3S/c1-30(28,29)18-19-6-4-9-21(16-19)24(27)26-14-12-25(13-15-26)17-22-10-5-8-20-7-2-3-11-23(20)22/h2-11,16H,12-15,17-18H2,1H3/p+1