3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methyl-indole-5-carboxylic acid

Systemtic Name: 3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methyl-indole-5-carboxylic acid Openeye Name: 3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methyl-indole-5-carboxylic acid CAS Name: 3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methyl-5-indolecarboxylic acid IUPAC Name: 3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methylindole-5-carboxylic acid Traditional Name: 3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-1-methyl-indole-5-carboxylic acid Formula: C18H12N4O2 MolecularWeight: 316.31348

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C(=O)O)C3=CC4=C(C=CN=C4N3)C#N

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)C(=O)O)C3=CC4=C(C=CN=C4N3)C#N

InChI

InChI=1S/C18H12N4O2/c1-22-9-14(13-6-10(18(23)24)2-3-16(13)22)15-7-12-11(8-19)4-5-20-17(12)21-15/h2-7,9H,1H3,(H,20,21)(H,23,24)