methyl (4Z)-4-[(5-bromanyl-2-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C(C=CC(=C2)Br)O)C(=O)N1C3=CC=C(C=C3)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=C(C=CC(=C2)Br)O)/C(=O)N1C3=CC=C(C=C3)C(C)C)C(=O)OC

InChI

InChI=1S/C23H22BrNO4/c1-13(2)15-5-8-18(9-6-15)25-14(3)21(23(28)29-4)19(22(25)27)12-16-11-17(24)7-10-20(16)26/h5-13,26H,1-4H3/b19-12-