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

Systemtic Name: ethyl 1-[4-(dicyclopropylmethylcarbamoyl)phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(dicyclopropylmethylcarbamoyl)phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(dicyclopropylmethylamino)-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(dicyclopropylmethylcarbamoyl)phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-(dicyclopropylmethylcarbamoyl)phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC(C3CC3)C4CC4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC(C3CC3)C4CC4)C

InChI

InChI=1S/C21H25N3O3/c1-3-27-21(26)18-12-22-24(13(18)2)17-10-8-16(9-11-17)20(25)23-19(14-4-5-14)15-6-7-15/h8-12,14-15,19H,3-7H2,1-2H3,(H,23,25)