ethyl 1-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[(1Z)-1-[ethoxy(hydroxy)methylene]-2-oxo-propyl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylate CAS Name: 1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-2,5-dimethyl-4-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-2,5-dimethyl-4-phenylpyrrole-3-carboxylate Traditional Name: 1-[(Z)-1-acetyl-2-ethoxy-2-hydroxy-vinyl]-2,5-dimethyl-4-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=CC=C2)C)/C(=C(/O)\OCC)/C(=O)C)C

InChI

InChI=1S/C21H25NO5/c1-6-26-20(24)18-14(4)22(19(15(5)23)21(25)27-7-2)13(3)17(18)16-11-9-8-10-12-16/h8-12,25H,6-7H2,1-5H3/b21-19-