2,5-bis(2-azanylpyridin-3-yl)terephthalic acid

Systemtic Name: 2,5-bis(2-azanylpyridin-3-yl)terephthalic acid Openeye Name: 2,5-bis(2-amino-3-pyridyl)terephthalic acid CAS Name: 2,5-bis(2-amino-3-pyridinyl)terephthalic acid IUPAC Name: 2,5-bis(2-aminopyridin-3-yl)terephthalic acid Traditional Name: 2,5-bis(2-amino-3-pyridyl)terephthalic acid Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N)C2=CC(=C(C=C2C(=O)O)C3=C(N=CC=C3)N)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)N)C2=CC(=C(C=C2C(=O)O)C3=C(N=CC=C3)N)C(=O)O

InChI

InChI=1S/C18H14N4O4/c19-15-9(3-1-5-21-15)11-7-14(18(25)26)12(8-13(11)17(23)24)10-4-2-6-22-16(10)20/h1-8H,(H2,19,21)(H2,20,22)(H,23,24)(H,25,26)