4-[6-azanyl-5-cyano-4-(furan-2-yl)pyridin-2-yl]benzoic acid

Systemtic Name: 4-[6-azanyl-5-cyano-4-(furan-2-yl)pyridin-2-yl]benzoic acid Openeye Name: 4-[6-amino-5-cyano-4-(2-furyl)-2-pyridyl]benzoic acid CAS Name: 4-[6-amino-5-cyano-4-(2-furanyl)-2-pyridinyl]benzoic acid IUPAC Name: 4-[6-amino-5-cyano-4-(furan-2-yl)pyridin-2-yl]benzoic acid Traditional Name: 4-[6-amino-5-cyano-4-(2-furyl)-2-pyridyl]benzoic acid Formula: C17H11N3O3 MolecularWeight: 305.28754

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=COC(=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H11N3O3/c18-9-13-12(15-2-1-7-23-15)8-14(20-16(13)19)10-3-5-11(6-4-10)17(21)22/h1-8H,(H2,19,20)(H,21,22)