methyl 2,4-dimethyl-5-[2-(4-pyrazol-1-ylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(4-pyrazol-1-ylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(4-pyrazol-1-ylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[oxo-[4-(1-pyrazolyl)phenyl]methoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(4-pyrazol-1-ylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(4-pyrazol-1-ylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H21N3O5/c1-12-17(21(27)28-4)13(2)23-18(12)19(25)14(3)29-20(26)15-6-8-16(9-7-15)24-11-5-10-22-24/h5-11,14,23H,1-4H3