2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-1-phenethyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Systemtic Name: 2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-oxidanyl-1-phenethyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-1-phenethyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-1-phenethyl-2H-pyrrol-5-one IUPAC Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-phenethyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-3-hydroxy-1-phenethyl-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C28H24BrNO5 MolecularWeight: 534.39786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)C=CC4=CC=CC=C4)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)/C=C/C4=CC=CC=C4)Br)O

InChI

InChI=1S/C28H24BrNO5/c1-35-23-17-20(16-21(29)26(23)32)25-24(22(31)13-12-18-8-4-2-5-9-18)27(33)28(34)30(25)15-14-19-10-6-3-7-11-19/h2-13,16-17,25,32-33H,14-15H2,1H3/b13-12+