3-[7-fluoranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[7-fluoranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]propanoic acid Openeye Name: 3-[7-fluoro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]propanoic acid CAS Name: 3-[7-fluoro-1-(4-methoxyphenyl)sulfonyl-3-indolyl]propanoic acid IUPAC Name: 3-[7-fluoro-1-(4-methoxyphenyl)sulfonylindol-3-yl]propanoic acid Traditional Name: 3-[7-fluoro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]propionic acid Formula: C18H16FNO5S MolecularWeight: 377.386743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=CC=C3)F)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=CC=C3)F)CCC(=O)O

InChI

InChI=1S/C18H16FNO5S/c1-25-13-6-8-14(9-7-13)26(23,24)20-11-12(5-10-17(21)22)15-3-2-4-16(19)18(15)20/h2-4,6-9,11H,5,10H2,1H3,(H,21,22)