ethyl 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methyl-pyrazole-3-carboxylate CAS Name: 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methylpyrazole-3-carboxylate Traditional Name: 1-(2-chlorophenyl)-5-(4-cyclopropylphenyl)-4-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C22H21ClN2O2 MolecularWeight: 380.86734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)C3CC3)C4=CC=CC=C4Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)C3CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H21ClN2O2/c1-3-27-22(26)20-14(2)21(17-12-10-16(11-13-17)15-8-9-15)25(24-20)19-7-5-4-6-18(19)23/h4-7,10-13,15H,3,8-9H2,1-2H3