dimethyl 5-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[2-(4-chloro-3,5-dimethylpyrazol-1-yl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)propanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H20ClN3O5 MolecularWeight: 393.8215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)Cl

InChI

InChI=1S/C18H20ClN3O5/c1-9-15(19)10(2)22(21-9)11(3)16(23)20-14-7-12(17(24)26-4)6-13(8-14)18(25)27-5/h6-8,11H,1-5H3,(H,20,23)