3-[(6-azanylpyridin-3-yl)amino]-5-carboxy-benzoate

Systemtic Name: 3-[(6-azanylpyridin-3-yl)amino]-5-carboxy-benzoate Openeye Name: 3-[(6-amino-3-pyridyl)amino]-5-carboxy-benzoate CAS Name: 3-[(6-amino-3-pyridinyl)amino]-5-carboxybenzoate IUPAC Name: 3-[(6-aminopyridin-3-yl)amino]-5-carboxybenzoate Traditional Name: 3-[(6-amino-3-pyridyl)amino]-5-carboxy-benzoate Formula: C13H10N3O4- MolecularWeight: 272.2362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NC2=CC(=CC(=C2)C(=O)O)C(=O)[O-])N

Isomeric SMILES

C1=CC(=NC=C1NC2=CC(=CC(=C2)C(=O)O)C(=O)[O-])N

InChI

InChI=1S/C13H11N3O4/c14-11-2-1-9(6-15-11)16-10-4-7(12(17)18)3-8(5-10)13(19)20/h1-6,16H,(H2,14,15)(H,17,18)(H,19,20)/p-1