methyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2,4-bis(oxidanylidene)butanoate

Systemtic Name: methyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2,4-bis(oxidanylidene)butanoate Openeye Name: methyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2,4-dioxo-butanoate CAS Name: 4-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2,4-dioxobutanoic acid methyl ester IUPAC Name: methyl 4-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2,4-dioxobutanoate Traditional Name: 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2,4-diketo-butyric acid methyl ester Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)CC(=O)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)CC(=O)C(=O)OC

InChI

InChI=1S/C16H16N2O4/c1-10-15(13(19)9-14(20)16(21)22-3)11(2)18(17-10)12-7-5-4-6-8-12/h4-8H,9H2,1-3H3