1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-triazole-4-carboxylic acid CAS Name: 1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-4-triazolecarboxylic acid IUPAC Name: 1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyltriazole-4-carboxylic acid Traditional Name: 1-(3-phenylanthranil-5-yl)-5-propyl-triazole-4-carboxylic acid Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C19H16N4O3/c1-2-6-16-17(19(24)25)20-22-23(16)13-9-10-15-14(11-13)18(26-21-15)12-7-4-3-5-8-12/h3-5,7-11H,2,6H2,1H3,(H,24,25)