2-(2-fluoranylphenoxy)ethyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(2-fluorophenoxy)ethyl-methyl-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: 2-(2-fluorophenoxy)ethyl-methyl-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: 2-(2-fluorophenoxy)ethyl-methyl-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: 2-(2-fluorophenoxy)ethyl-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]-methyl-ammonium Formula: C25H29FN3O4S+ MolecularWeight: 486.578863

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1F)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1F)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28FN3O4S/c1-27(16-17-33-24-9-5-4-8-23(24)26)19-25(30)28-12-14-29(15-13-28)34(31,32)22-11-10-20-6-2-3-7-21(20)18-22/h2-11,18H,12-17,19H2,1H3/p+1