2-(4-methoxyphenyl)ethyl 5-chloranyl-3-methyl-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: 2-(4-methoxyphenyl)ethyl 5-chloranyl-3-methyl-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: 2-(4-methoxyphenyl)ethyl 1-benzyl-5-chloro-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid 2-(4-methoxyphenyl)ethyl ester IUPAC Name: 2-(4-methoxyphenyl)ethyl 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate Traditional Name: 1-benzyl-5-chloro-3-methyl-pyrazole-4-carboxylic acid 2-(4-methoxyphenyl)ethyl ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCCC2=CC=C(C=C2)OC)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCCC2=CC=C(C=C2)OC)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H21ClN2O3/c1-15-19(20(22)24(23-15)14-17-6-4-3-5-7-17)21(25)27-13-12-16-8-10-18(26-2)11-9-16/h3-11H,12-14H2,1-2H3