ethyl 5-[(2-aminophenyl)methyl]-1-(3-chlorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-aminophenyl)methyl]-1-(3-chlorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-aminophenyl)methyl]-1-(3-chlorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-[(2-aminophenyl)methyl]-1-(3-chlorophenyl)-3-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-aminophenyl)methyl]-1-(3-chlorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-(2-aminobenzyl)-1-(3-chlorophenyl)-3-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=CC(=CC=C2)Cl)CC3=CC=CC=C3N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=CC(=CC=C2)Cl)CC3=CC=CC=C3N

InChI

InChI=1S/C20H20ClN3O2/c1-3-26-20(25)19-13(2)23-24(16-9-6-8-15(21)12-16)18(19)11-14-7-4-5-10-17(14)22/h4-10,12H,3,11,22H2,1-2H3