2-[1-methyl-3-[1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-2-yl]indol-5-yl]oxypropanoic acid

Systemtic Name: 2-[1-methyl-3-[1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-2-yl]indol-5-yl]oxypropanoic acid Openeye Name: 2-[1-methyl-3-[1-(p-tolylsulfonyl)pyrrolo[2,3-b]pyridin-2-yl]indol-5-yl]oxypropanoic acid CAS Name: 2-[[1-methyl-3-[1-(4-methylphenyl)sulfonyl-2-pyrrolo[2,3-b]pyridinyl]-5-indolyl]oxy]propanoic acid IUPAC Name: 2-[1-methyl-3-[1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-2-yl]indol-5-yl]oxypropanoic acid Traditional Name: 2-[1-methyl-3-(1-tosylpyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxypropionic acid Formula: C26H23N3O5S MolecularWeight: 489.54292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2N=CC=C3)C4=CN(C5=C4C=C(C=C5)OC(C)C(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2N=CC=C3)C4=CN(C5=C4C=C(C=C5)OC(C)C(=O)O)C

InChI

InChI=1S/C26H23N3O5S/c1-16-6-9-20(10-7-16)35(32,33)29-24(13-18-5-4-12-27-25(18)29)22-15-28(3)23-11-8-19(14-21(22)23)34-17(2)26(30)31/h4-15,17H,1-3H3,(H,30,31)