ethyl 4-[(1E,3E)-5-ethoxy-5-oxidanylidene-penta-1,3-dienyl]-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(1E,3E)-5-ethoxy-5-oxidanylidene-penta-1,3-dienyl]-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(1E,3E)-5-ethoxy-5-oxo-penta-1,3-dienyl]-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate CAS Name: 4-[(1E,3E)-5-ethoxy-5-oxopenta-1,3-dienyl]-1-methyl-2,5-diphenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1E,3E)-5-ethoxy-5-oxopenta-1,3-dienyl]-1-methyl-2,5-diphenylpyrrole-3-carboxylate Traditional Name: 4-[(1E,3E)-5-ethoxy-5-keto-penta-1,3-dienyl]-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC=CC1=C(N(C(=C1C(=O)OCC)C2=CC=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C/C=C/C1=C(N(C(=C1C(=O)OCC)C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C27H27NO4/c1-4-31-23(29)19-13-12-18-22-24(27(30)32-5-2)26(21-16-10-7-11-17-21)28(3)25(22)20-14-8-6-9-15-20/h6-19H,4-5H2,1-3H3/b18-12+,19-13+