methyl (2R)-2-[3-methyl-4-(4-methylphenyl)-5-oxidanylidene-1,2,4-triazol-1-yl]propanoate

Systemtic Name: methyl (2R)-2-[3-methyl-4-(4-methylphenyl)-5-oxidanylidene-1,2,4-triazol-1-yl]propanoate Openeye Name: methyl (2R)-2-[3-methyl-5-oxo-4-(p-tolyl)-1,2,4-triazol-1-yl]propanoate CAS Name: (2R)-2-[3-methyl-4-(4-methylphenyl)-5-oxo-1,2,4-triazol-1-yl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-methyl-4-(4-methylphenyl)-5-oxo-1,2,4-triazol-1-yl]propanoate Traditional Name: (2R)-2-[5-keto-3-methyl-4-(p-tolyl)-1,2,4-triazol-1-yl]propionic acid methyl ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN(C2=O)C(C)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN(C2=O)[C@H](C)C(=O)OC)C

InChI

InChI=1S/C14H17N3O3/c1-9-5-7-12(8-6-9)16-11(3)15-17(14(16)19)10(2)13(18)20-4/h5-8,10H,1-4H3/t10-/m1/s1