ethyl 1-[4-(cyclopropylmethylcarbamoyl)phenyl]-5-(2,4-dichlorophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[4-(cyclopropylmethylcarbamoyl)phenyl]-5-(2,4-dichlorophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 1-[4-(cyclopropylmethylcarbamoyl)phenyl]-5-(2,4-dichlorophenyl)pyrazole-3-carboxylate CAS Name: 1-[4-[(cyclopropylmethylamino)-oxomethyl]phenyl]-5-(2,4-dichlorophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(cyclopropylmethylcarbamoyl)phenyl]-5-(2,4-dichlorophenyl)pyrazole-3-carboxylate Traditional Name: 1-[4-(cyclopropylmethylcarbamoyl)phenyl]-5-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C23H21Cl2N3O3 MolecularWeight: 458.33714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C(=O)NCC4CC4

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C(=O)NCC4CC4

InChI

InChI=1S/C23H21Cl2N3O3/c1-2-31-23(30)20-12-21(18-10-7-16(24)11-19(18)25)28(27-20)17-8-5-15(6-9-17)22(29)26-13-14-3-4-14/h5-12,14H,2-4,13H2,1H3,(H,26,29)