ethyl 1-[4-[(4-chlorophenyl)methyl-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(4-chlorophenyl)methyl-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(4-chlorophenyl)methyl-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[(4-chlorophenyl)methyl-methylamino]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(4-chlorophenyl)methyl-methylcarbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[(4-chlorobenzyl)-methyl-carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H22ClN3O3/c1-4-29-22(28)20-13-24-26(15(20)2)19-11-7-17(8-12-19)21(27)25(3)14-16-5-9-18(23)10-6-16/h5-13H,4,14H2,1-3H3