O2-ethyl O4-[(4-pyrazol-1-ylphenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-[(4-pyrazol-1-ylphenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-ethyl O4-[(4-pyrazol-1-ylphenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-[[4-(1-pyrazolyl)phenyl]methyl] ester IUPAC Name: 2-O-ethyl 4-O-[(4-pyrazol-1-ylphenyl)methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-ethyl ester O4-(4-pyrazol-1-ylbenzyl) ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C20H21N3O4/c1-4-26-20(25)18-13(2)17(14(3)22-18)19(24)27-12-15-6-8-16(9-7-15)23-11-5-10-21-23/h5-11,22H,4,12H2,1-3H3