2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxy-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxy-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxy-indol-1-yl]acetic acid CAS Name: 2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxy-1-indolyl]acetic acid IUPAC Name: 2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxyindol-1-yl]acetic acid Traditional Name: 2-[3-(4-cyano-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-methoxy-indol-1-yl]acetic acid Formula: C19H14N4O3 MolecularWeight: 346.33946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C3=CC4=C(C=CN=C4N3)C#N)CC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C3=CC4=C(C=CN=C4N3)C#N)CC(=O)O

InChI

InChI=1S/C19H14N4O3/c1-26-12-2-3-17-14(6-12)15(9-23(17)10-18(24)25)16-7-13-11(8-20)4-5-21-19(13)22-16/h2-7,9H,10H2,1H3,(H,21,22)(H,24,25)