1-(4-fluorophenyl)sulfonyl-4-[(2R)-4-phenylbutan-2-yl]piperazin-4-ium

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-4-[(2R)-4-phenylbutan-2-yl]piperazin-4-ium Openeye Name: 1-(4-fluorophenyl)sulfonyl-4-[(1R)-1-methyl-3-phenyl-propyl]piperazin-4-ium CAS Name: 1-(4-fluorophenyl)sulfonyl-4-[(2R)-4-phenylbutan-2-yl]piperazin-4-ium IUPAC Name: 1-(4-fluorophenyl)sulfonyl-4-[(2R)-4-phenylbutan-2-yl]piperazin-4-ium Traditional Name: 1-(4-fluorophenyl)sulfonyl-4-[(1R)-1-methyl-3-phenyl-propyl]piperazin-4-ium Formula: C20H26FN2O2S+ MolecularWeight: 377.496043

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN2O2S/c1-17(7-8-18-5-3-2-4-6-18)22-13-15-23(16-14-22)26(24,25)20-11-9-19(21)10-12-20/h2-6,9-12,17H,7-8,13-16H2,1H3/p+1/t17-/m1/s1