2-[5-aminocarbonyl-3-fluoranyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxyethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-3-fluoranyl-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[5-carbamoyl-3-fluoro-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxyacetic acid CAS Name: 2-[[5-carbamoyl-3-fluoro-9-[(3-methylsulfonylphenyl)methyl]-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[5-carbamoyl-3-fluoro-9-[(3-methylsulfonylphenyl)methyl]carbazol-4-yl]oxyacetic acid Traditional Name: 2-[5-carbamoyl-3-fluoro-9-(3-mesylbenzyl)carbazol-4-yl]oxyacetic acid Formula: C23H19FN2O6S MolecularWeight: 470.470163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)CN2C3=C(C4=C(C=CC=C42)C(=O)N)C(=C(C=C3)F)OCC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)CN2C3=C(C4=C(C=CC=C42)C(=O)N)C(=C(C=C3)F)OCC(=O)O

InChI

InChI=1S/C23H19FN2O6S/c1-33(30,31)14-5-2-4-13(10-14)11-26-17-7-3-6-15(23(25)29)20(17)21-18(26)9-8-16(24)22(21)32-12-19(27)28/h2-10H,11-12H2,1H3,(H2,25,29)(H,27,28)