4-[6-azanyl-5-cyano-4-(1H-imidazol-5-yl)pyridin-2-yl]benzoic acid

Systemtic Name: 4-[6-azanyl-5-cyano-4-(1H-imidazol-5-yl)pyridin-2-yl]benzoic acid Openeye Name: 4-[6-amino-5-cyano-4-(1H-imidazol-5-yl)-2-pyridyl]benzoic acid CAS Name: 4-[6-amino-5-cyano-4-(1H-imidazol-5-yl)-2-pyridinyl]benzoic acid IUPAC Name: 4-[6-amino-5-cyano-4-(1H-imidazol-5-yl)pyridin-2-yl]benzoic acid Traditional Name: 4-[6-amino-5-cyano-4-(1H-imidazol-5-yl)-2-pyridyl]benzoic acid Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=C(C(=C2)C3=CN=CN3)C#N)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=C(C(=C2)C3=CN=CN3)C#N)N)C(=O)O

InChI

InChI=1S/C16H11N5O2/c17-6-12-11(14-7-19-8-20-14)5-13(21-15(12)18)9-1-3-10(4-2-9)16(22)23/h1-5,7-8H,(H2,18,21)(H,19,20)(H,22,23)