2-[5-bromanyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]oxyethanoic acid

Systemtic Name: 2-[5-bromanyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]oxyethanoic acid Openeye Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]oxyacetic acid CAS Name: 2-[[5-bromo-1-(4-methoxyphenyl)sulfonyl-3-indolyl]oxy]acetic acid IUPAC Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonylindol-3-yl]oxyacetic acid Traditional Name: 2-[5-bromo-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]oxyacetic acid Formula: C17H14BrNO6S MolecularWeight: 440.26516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)OCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Br)OCC(=O)O

InChI

InChI=1S/C17H14BrNO6S/c1-24-12-3-5-13(6-4-12)26(22,23)19-9-16(25-10-17(20)21)14-8-11(18)2-7-15(14)19/h2-9H,10H2,1H3,(H,20,21)