2-[5-fluoranyl-2-methyl-1-(3-nitrophenyl)sulfonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-methyl-1-(3-nitrophenyl)sulfonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-methyl-1-(3-nitrophenyl)sulfonyl-indol-3-yl]acetic acid CAS Name: 2-[5-fluoro-2-methyl-1-(3-nitrophenyl)sulfonyl-3-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-methyl-1-(3-nitrophenyl)sulfonylindol-3-yl]acetic acid Traditional Name: 2-[5-fluoro-2-methyl-1-(3-nitrophenyl)sulfonyl-indol-3-yl]acetic acid Formula: C17H13FN2O6S MolecularWeight: 392.358323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C=CC(=C2)F)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C=CC(=C2)F)CC(=O)O

InChI

InChI=1S/C17H13FN2O6S/c1-10-14(9-17(21)22)15-7-11(18)5-6-16(15)19(10)27(25,26)13-4-2-3-12(8-13)20(23)24/h2-8H,9H2,1H3,(H,21,22)