3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid

Systemtic Name: 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid Openeye Name: 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid CAS Name: 3-[[2-(5-methoxy-1-methyl-3-indolyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid IUPAC Name: 3-[[2-(5-methoxy-1-methylindol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid Traditional Name: 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid Formula: C24H20N4O3 MolecularWeight: 412.4406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(C=CN=C4N3)NC5=CC=CC(=C5)C(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(C=CN=C4N3)NC5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C24H20N4O3/c1-28-13-19(17-11-16(31-2)6-7-22(17)28)21-12-18-20(8-9-25-23(18)27-21)26-15-5-3-4-14(10-15)24(29)30/h3-13H,1-2H3,(H,29,30)(H2,25,26,27)