2-(phenylcarbonyloxy)ethyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: 2-benzoyloxyethyl 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxylic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 5-chloro-3-methyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxylic acid 2-benzoyloxyethyl ester Formula: C20H17ClN2O4 MolecularWeight: 384.81298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCCOC(=O)C2=CC=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCCOC(=O)C2=CC=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN2O4/c1-14-17(18(21)23(22-14)16-10-6-3-7-11-16)20(25)27-13-12-26-19(24)15-8-4-2-5-9-15/h2-11H,12-13H2,1H3