5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-2-oxidanyl-benzoic acid Openeye Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-2-hydroxy-benzoic acid CAS Name: 5-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]sulfonyl]-2-hydroxybenzoic acid IUPAC Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-2-hydroxybenzoic acid Traditional Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazino]sulfonyl-2-hydroxy-benzoic acid Formula: C24H22F2N2O5S MolecularWeight: 488.503686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC(=C(C=C4)O)C(=O)O

Isomeric SMILES

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C24H22F2N2O5S/c25-18-5-1-16(2-6-18)23(17-3-7-19(26)8-4-17)27-11-13-28(14-12-27)34(32,33)20-9-10-22(29)21(15-20)24(30)31/h1-10,15,23,29H,11-14H2,(H,30,31)