2-methyl-2-[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxy-propanedioic acid

Systemtic Name: 2-methyl-2-[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxy-propanedioic acid Openeye Name: 2-methyl-2-[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxy-propanedioic acid CAS Name: 2-methyl-2-[[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)-5-indolyl]oxy]propanedioic acid IUPAC Name: 2-methyl-2-[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxypropanedioic acid Traditional Name: 2-methyl-2-[1-methyl-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)indol-5-yl]oxy-malonic acid Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(C(=O)O)OC1=CC2=C(C=C1)N(C=C2C3=CC4=C(N3)N=CC=C4)C

Isomeric SMILES

CC(C(=O)O)(C(=O)O)OC1=CC2=C(C=C1)N(C=C2C3=CC4=C(N3)N=CC=C4)C

InChI

InChI=1S/C20H17N3O5/c1-20(18(24)25,19(26)27)28-12-5-6-16-13(9-12)14(10-23(16)2)15-8-11-4-3-7-21-17(11)22-15/h3-10H,1-2H3,(H,21,22)(H,24,25)(H,26,27)