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3-bromanyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indole-2-carboxylic acid

3-bromanyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indole-2-carboxylic acid

Systemtic Name:3-bromanyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indole-2-carboxylic acid
Openeye Name:3-bromo-1-[3-(trifluoromethyl)phenyl]sulfonyl-indole-2-carboxylic acid
CAS Name:3-bromo-1-[3-(trifluoromethyl)phenyl]sulfonyl-2-indolecarboxylic acid
IUPAC Name:3-bromo-1-[3-(trifluoromethyl)phenyl]sulfonylindole-2-carboxylic acid
Traditional Name:3-bromo-1-[3-(trifluoromethyl)phenyl]sulfonyl-indole-2-carboxylic acid
Formula: C16H9BrF3NO4S
MolecularWeight: 448.21117
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)O)Br


Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)O)Br


InChI

InChI=1S/C16H9BrF3NO4S/c17-13-11-6-1-2-7-12(11)21(14(13)15(22)23)26(24,25)10-5-3-4-9(8-10)16(18,19)20/h1-8H,(H,22,23)


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