3-[5-oxidanylidene-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid

Systemtic Name: 3-[5-oxidanylidene-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid Openeye Name: 3-[3-(4-benzyloxyphenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propanoic acid CAS Name: 3-[5-oxo-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid IUPAC Name: 3-[5-oxo-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid Traditional Name: 3-[3-(4-benzoxyphenyl)-5-keto-2H-1,2,4-triazin-6-yl]propionic acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC(=O)C(=NN3)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC(=O)C(=NN3)CCC(=O)O

InChI

InChI=1S/C19H17N3O4/c23-17(24)11-10-16-19(25)20-18(22-21-16)14-6-8-15(9-7-14)26-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,23,24)(H,20,22,25)