ethyl (4Z)-4-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-1-(3,4-dimethylphenyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl (4Z)-4-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-1-(3,4-dimethylphenyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl (4Z)-4-[(5-bromo-2-hydroxy-phenyl)methylene]-1-(3,4-dimethylphenyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3,4-dimethylphenyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-4-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(3,4-dimethylphenyl)-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(5-bromo-2-hydroxy-benzylidene)-1-(3,4-dimethylphenyl)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C23H22BrNO4 MolecularWeight: 456.32908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C\1=C(N(C(=O)/C1=C\C2=C(C=CC(=C2)Br)O)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C23H22BrNO4/c1-5-29-23(28)21-15(4)25(18-8-6-13(2)14(3)10-18)22(27)19(21)12-16-11-17(24)7-9-20(16)26/h6-12,26H,5H2,1-4H3/b19-12-