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

Systemtic Name: O4-[(4-bromophenyl)methyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[(4-bromophenyl)methyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[(4-bromophenyl)methyl] ester O2-ethyl ester IUPAC Name: 4-O-[(4-bromophenyl)methyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-(4-bromobenzyl) ester O2-ethyl ester Formula: C17H18BrNO4 MolecularWeight: 380.23312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C17H18BrNO4/c1-4-22-17(21)15-10(2)14(11(3)19-15)16(20)23-9-12-5-7-13(18)8-6-12/h5-8,19H,4,9H2,1-3H3