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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)N(C(=N2)C)CCOC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)N(C(=N2)C)CCOC(=O)C

InChI

InChI=1S/C14H17N3O3/c1-10-4-6-13(7-5-10)17-14(19)16(11(2)15-17)8-9-20-12(3)18/h4-7H,8-9H2,1-3H3