methyl 4-[(3Z)-3-[(3-bromanyl-4-methoxy-phenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 4-[(3Z)-3-[(3-bromanyl-4-methoxy-phenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate Openeye Name: methyl 4-[(3Z)-3-[(3-bromo-4-methoxy-phenyl)methylene]-2-oxo-5-phenyl-pyrrol-1-yl]benzoate CAS Name: 4-[(3Z)-3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3Z)-3-[(3-bromo-4-methoxyphenyl)methylidene]-2-oxo-5-phenylpyrrol-1-yl]benzoate Traditional Name: 4-[(3Z)-3-(3-bromo-4-methoxy-benzylidene)-2-keto-5-phenyl-2-pyrrolin-1-yl]benzoic acid methyl ester Formula: C26H20BrNO4 MolecularWeight: 490.3453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C=C(N(C2=O)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C\2/C=C(N(C2=O)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)Br

InChI

InChI=1S/C26H20BrNO4/c1-31-24-13-8-17(15-22(24)27)14-20-16-23(18-6-4-3-5-7-18)28(25(20)29)21-11-9-19(10-12-21)26(30)32-2/h3-16H,1-2H3/b20-14-