4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid

Systemtic Name: 4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid Openeye Name: 4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid CAS Name: 4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid IUPAC Name: 4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid Traditional Name: 4-([1,2,4]triazolo[4,3-c]quinazolin-5-ylamino)benzoic acid Formula: C16H11N5O2 MolecularWeight: 305.29084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NN=CN3C(=N2)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=NN=CN3C(=N2)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C16H11N5O2/c22-15(23)10-5-7-11(8-6-10)18-16-19-13-4-2-1-3-12(13)14-20-17-9-21(14)16/h1-9H,(H,18,19)(H,22,23)