(diphenylmethyl)-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (diphenylmethyl)-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: benzhydryl-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: (diphenylmethyl)-[2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-methylammonium IUPAC Name: benzhydryl-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-methylazanium Traditional Name: benzhydryl-[2-[4-(3-fluorophenyl)sulfonylpiperazino]-2-keto-ethyl]-methyl-ammonium Formula: C26H29FN3O3S+ MolecularWeight: 482.590163

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28FN3O3S/c1-28(26(21-9-4-2-5-10-21)22-11-6-3-7-12-22)20-25(31)29-15-17-30(18-16-29)34(32,33)24-14-8-13-23(27)19-24/h2-14,19,26H,15-18,20H2,1H3/p+1