5-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-[[5-(4-chlorophenyl)-2-methyl-3-pyrazolyl]amino]-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-[[5-(4-chlorophenyl)-2-methylpyrazol-3-yl]amino]-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-[[5-(4-chlorophenyl)-2-methyl-pyrazol-3-yl]amino]-5-keto-3,3-dimethyl-valerate Formula: C17H19ClN3O3- MolecularWeight: 348.80406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)NC1=CC(=NN1C)C2=CC=C(C=C2)Cl)CC(=O)[O-]

InChI

InChI=1S/C17H20ClN3O3/c1-17(2,10-16(23)24)9-15(22)19-14-8-13(20-21(14)3)11-4-6-12(18)7-5-11/h4-8H,9-10H2,1-3H3,(H,19,22)(H,23,24)/p-1