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

Systemtic Name: 3-[5-oxidanylidene-3-(3-propoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid Openeye Name: 3-[5-oxo-3-(3-propoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid CAS Name: 3-[5-oxo-3-(3-propoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid IUPAC Name: 3-[5-oxo-3-(3-propoxyphenyl)-2H-1,2,4-triazin-6-yl]propanoic acid Traditional Name: 3-[5-keto-3-(3-propoxyphenyl)-2H-1,2,4-triazin-6-yl]propionic acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NC(=O)C(=NN2)CCC(=O)O

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NC(=O)C(=NN2)CCC(=O)O

InChI

InChI=1S/C15H17N3O4/c1-2-8-22-11-5-3-4-10(9-11)14-16-15(21)12(17-18-14)6-7-13(19)20/h3-5,9H,2,6-8H2,1H3,(H,19,20)(H,16,18,21)