methyl (4Z)-1-(3-bromophenyl)-4-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-1-(3-bromophenyl)-4-[(3-ethoxy-4-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-(3-bromophenyl)-4-[(3-ethoxy-4-hydroxy-phenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-1-(3-bromophenyl)-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1-(3-bromophenyl)-4-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-1-(3-bromophenyl)-4-(3-ethoxy-4-hydroxy-benzylidene)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C22H20BrNO5 MolecularWeight: 458.3019

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=C(N(C2=O)C3=CC(=CC=C3)Br)C)C(=O)OC)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=C(N(C2=O)C3=CC(=CC=C3)Br)C)C(=O)OC)O

InChI

InChI=1S/C22H20BrNO5/c1-4-29-19-11-14(8-9-18(19)25)10-17-20(22(27)28-3)13(2)24(21(17)26)16-7-5-6-15(23)12-16/h5-12,25H,4H2,1-3H3/b17-10-