ethyl 5-methyl-1-[4-[methyl(4-methylpentan-2-yl)carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[methyl(4-methylpentan-2-yl)carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[1,3-dimethylbutyl(methyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[methyl(4-methylpentan-2-yl)amino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[methyl(4-methylpentan-2-yl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-[1,3-dimethylbutyl(methyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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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)C(C)CC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3/c1-7-27-21(26)19-13-22-24(16(19)5)18-10-8-17(9-11-18)20(25)23(6)15(4)12-14(2)3/h8-11,13-15H,7,12H2,1-6H3