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

Systemtic Name: 3-[1-(4-methoxyphenyl)sulfonyl-7-methyl-indol-3-yl]propanoic acid Openeye Name: 3-[1-(4-methoxyphenyl)sulfonyl-7-methyl-indol-3-yl]propanoic acid CAS Name: 3-[1-(4-methoxyphenyl)sulfonyl-7-methyl-3-indolyl]propanoic acid IUPAC Name: 3-[1-(4-methoxyphenyl)sulfonyl-7-methylindol-3-yl]propanoic acid Traditional Name: 3-[1-(4-methoxyphenyl)sulfonyl-7-methyl-indol-3-yl]propionic acid Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC2=C1N(C=C2CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

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