ethyl 1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-5-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-5-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-[2-(4-methoxyphenyl)-2-oxo-ethyl]-5-methyl-pyrazole-3-carboxylate CAS Name: 1-[2-(4-methoxyphenyl)-2-oxoethyl]-5-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methoxyphenyl)-2-oxoethyl]-5-methylpyrazole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-methoxyphenyl)ethyl]-5-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C)CC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C)CC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H18N2O4/c1-4-22-16(20)14-9-11(2)18(17-14)10-15(19)12-5-7-13(21-3)8-6-12/h5-9H,4,10H2,1-3H3