ethyl 5-methyl-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-(m-tolylmethylcarbamoyl)phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[(3-methylphenyl)methylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[(3-methylbenzyl)carbamoyl]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=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCC3=CC=CC(=C3)C)C

InChI

InChI=1S/C22H23N3O3/c1-4-28-22(27)20-14-24-25(16(20)3)19-10-8-18(9-11-19)21(26)23-13-17-7-5-6-15(2)12-17/h5-12,14H,4,13H2,1-3H3,(H,23,26)