diethyl 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-methyl-3-phenyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2)C(=O)OCC)C

InChI

InChI=1S/C17H19NO4/c1-4-21-16(19)13-11(3)18-15(17(20)22-5-2)14(13)12-9-7-6-8-10-12/h6-10,18H,4-5H2,1-3H3