3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-fluoro-benzoic acid CAS Name: 3-[(4-cyclohexyl-1-piperazinyl)sulfonyl]-4-fluorobenzoic acid IUPAC Name: 3-(4-cyclohexylpiperazin-1-yl)sulfonyl-4-fluorobenzoic acid Traditional Name: 3-(4-cyclohexylpiperazino)sulfonyl-4-fluoro-benzoic acid Formula: C17H23FN2O4S MolecularWeight: 370.438923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)F

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)F

InChI

InChI=1S/C17H23FN2O4S/c18-15-7-6-13(17(21)22)12-16(15)25(23,24)20-10-8-19(9-11-20)14-4-2-1-3-5-14/h6-7,12,14H,1-5,8-11H2,(H,21,22)