ethyl 3,5-dimethyl-1-[4-[(2-methylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-1-[4-[(2-methylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 3,5-dimethyl-1-[4-(o-tolylcarbamoyl)phenyl]pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-[4-[(2-methylanilino)-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-1-[4-[(2-methylphenyl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-[4-(o-tolylcarbamoyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C)C

InChI

InChI=1S/C22H23N3O3/c1-5-28-22(27)20-15(3)24-25(16(20)4)18-12-10-17(11-13-18)21(26)23-19-9-7-6-8-14(19)2/h6-13H,5H2,1-4H3,(H,23,26)