3-[1-(4-methoxyphenyl)sulfonyl-6-methyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[1-(4-methoxyphenyl)sulfonyl-6-methyl-indol-3-yl]propanoic acid Openeye Name: 3-[1-(4-methoxyphenyl)sulfonyl-6-methyl-indol-3-yl]propanoic acid CAS Name: 3-[1-(4-methoxyphenyl)sulfonyl-6-methyl-3-indolyl]propanoic acid IUPAC Name: 3-[1-(4-methoxyphenyl)sulfonyl-6-methylindol-3-yl]propanoic acid Traditional Name: 3-[1-(4-methoxyphenyl)sulfonyl-6-methyl-indol-3-yl]propionic acid Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CN2S(=O)(=O)C3=CC=C(C=C3)OC)CCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CN2S(=O)(=O)C3=CC=C(C=C3)OC)CCC(=O)O

InChI

InChI=1S/C19H19NO5S/c1-13-3-9-17-14(4-10-19(21)22)12-20(18(17)11-13)26(23,24)16-7-5-15(25-2)6-8-16/h3,5-9,11-12H,4,10H2,1-2H3,(H,21,22)