methyl 4-[[[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C18H22ClN3O3 MolecularWeight: 363.83858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)C(=O)OC)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)C(=O)OC)Cl)CC(C)C

InChI

InChI=1S/C18H22ClN3O3/c1-11(2)10-22-16(19)15(12(3)21-22)17(23)20-9-13-5-7-14(8-6-13)18(24)25-4/h5-8,11H,9-10H2,1-4H3,(H,20,23)