[2-oxidanylidene-2-(phenethylamino)ethyl] 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-4-pyrazolecarboxylic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 5-chloro-1-[(2-chlorophenyl)methyl]-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(2-chlorobenzyl)-3-methyl-pyrazole-4-carboxylic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C22H21Cl2N3O3 MolecularWeight: 446.32644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC(=O)NCCC2=CC=CC=C2)Cl)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC(=O)NCCC2=CC=CC=C2)Cl)CC3=CC=CC=C3Cl

InChI

InChI=1S/C22H21Cl2N3O3/c1-15-20(21(24)27(26-15)13-17-9-5-6-10-18(17)23)22(29)30-14-19(28)25-12-11-16-7-3-2-4-8-16/h2-10H,11-14H2,1H3,(H,25,28)