diethyl 3-hexyl-5-methanoyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 3-hexyl-5-methanoyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-formyl-3-hexyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-formyl-3-hexyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-formyl-3-hexyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-formyl-3-hexyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C17H25NO5 MolecularWeight: 323.3841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=C1C(=O)OCC)C=O)C(=O)OCC

Isomeric SMILES

CCCCCCC1=C(NC(=C1C(=O)OCC)C=O)C(=O)OCC

InChI

InChI=1S/C17H25NO5/c1-4-7-8-9-10-12-14(16(20)22-5-2)13(11-19)18-15(12)17(21)23-6-3/h11,18H,4-10H2,1-3H3