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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=NC(=O)C(=NN2)CCC(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=NC(=O)C(=NN2)CCC(=O)O

InChI

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