ethyl (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-5-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-5-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC2=C(N(C(=C2)C)C3=CC=CC=C3)C)C1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3/c1-5-26-21(25)19-14(3)22-18(20(19)24)12-16-11-13(2)23(15(16)4)17-9-7-6-8-10-17/h6-12,22H,5H2,1-4H3/b18-12+