methyl (4Z)-4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxidanylidene-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxidanylidene-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1-(4-isopropylphenyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-(4-propan-2-ylphenyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-methyl-5-oxo-1-(4-propan-2-ylphenyl)pyrrole-3-carboxylate Traditional Name: (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-5-keto-2-methyl-1-p-cumenyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C24H22BrNO5 MolecularWeight: 484.33918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)N1C4=CC=C(C=C4)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC3=C(C=C2Br)OCO3)/C(=O)N1C4=CC=C(C=C4)C(C)C)C(=O)OC

InChI

InChI=1S/C24H22BrNO5/c1-13(2)15-5-7-17(8-6-15)26-14(3)22(24(28)29-4)18(23(26)27)9-16-10-20-21(11-19(16)25)31-12-30-20/h5-11,13H,12H2,1-4H3/b18-9-