ethyl 4-[5-(4-methylphenyl)-3-oxidanylidene-2H-1,2,4-triazin-6-yl]butanoate

Systemtic Name: ethyl 4-[5-(4-methylphenyl)-3-oxidanylidene-2H-1,2,4-triazin-6-yl]butanoate Openeye Name: ethyl 4-[3-oxo-5-(p-tolyl)-2H-1,2,4-triazin-6-yl]butanoate CAS Name: 4-[5-(4-methylphenyl)-3-oxo-2H-1,2,4-triazin-6-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-methylphenyl)-3-oxo-2H-1,2,4-triazin-6-yl]butanoate Traditional Name: 4-[3-keto-5-(p-tolyl)-2H-1,2,4-triazin-6-yl]butyric acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=NNC(=O)N=C1C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CCCC1=NNC(=O)N=C1C2=CC=C(C=C2)C

InChI

InChI=1S/C16H19N3O3/c1-3-22-14(20)6-4-5-13-15(17-16(21)19-18-13)12-9-7-11(2)8-10-12/h7-10H,3-6H2,1-2H3,(H,17,19,21)