(3-methoxycarbonylphenyl)methyl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid (3-carbomethoxybenzyl) ester Formula: C15H15ClN2O4 MolecularWeight: 322.7436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=CC=CC(=C2)C(=O)OC)Cl)C

InChI

InChI=1S/C15H15ClN2O4/c1-9-12(13(16)18(2)17-9)15(20)22-8-10-5-4-6-11(7-10)14(19)21-3/h4-7H,8H2,1-3H3