5-[5-[4-(3-fluorophenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[5-[4-(3-fluorophenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[5-[4-(3-fluorophenyl)piperazin-1-yl]sulfonylindolin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[5-[[4-(3-fluorophenyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]-5-oxopentanoic acid IUPAC Name: 5-[5-[4-(3-fluorophenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-5-oxopentanoic acid Traditional Name: 5-[5-[4-(3-fluorophenyl)piperazino]sulfonylindolin-1-yl]-5-keto-valeric acid Formula: C23H26FN3O5S MolecularWeight: 475.533043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)F)C(=O)CCCC(=O)O

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)F)C(=O)CCCC(=O)O

InChI

InChI=1S/C23H26FN3O5S/c24-18-3-1-4-19(16-18)25-11-13-26(14-12-25)33(31,32)20-7-8-21-17(15-20)9-10-27(21)22(28)5-2-6-23(29)30/h1,3-4,7-8,15-16H,2,5-6,9-14H2,(H,29,30)