dimethyl 3-[4-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C20H24ClN3O6 MolecularWeight: 437.87406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CN(N=C1)C(CC(=O)OC)CC(=O)OC)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=CN(N=C1)C(CC(=O)OC)CC(=O)OC)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H24ClN3O6/c1-20(2,30-16-7-5-13(21)6-8-16)19(27)23-14-11-22-24(12-14)15(9-17(25)28-3)10-18(26)29-4/h5-8,11-12,15H,9-10H2,1-4H3,(H,23,27)