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

Systemtic Name: methyl 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoate Openeye Name: methyl 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoate CAS Name: 3-[[2-(5-methoxy-1-methyl-3-indolyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(5-methoxy-1-methylindol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoate Traditional Name: 3-[[2-(5-methoxy-1-methyl-indol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]benzoic acid methyl ester Formula: C25H22N4O3 MolecularWeight: 426.46718

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H22N4O3/c1-29-14-20(18-12-17(31-2)7-8-23(18)29)22-13-19-21(9-10-26-24(19)28-22)27-16-6-4-5-15(11-16)25(30)32-3/h4-14H,1-3H3,(H2,26,27,28)