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

Systemtic Name: 2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-3-hydroxy-1-(3-imidazol-1-ylpropyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C26H24BrN3O5 MolecularWeight: 538.38986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C=CC4=CC=CC=C4)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)/C=C/C4=CC=CC=C4)Br)O

InChI

InChI=1S/C26H24BrN3O5/c1-35-21-15-18(14-19(27)24(21)32)23-22(20(31)9-8-17-6-3-2-4-7-17)25(33)26(34)30(23)12-5-11-29-13-10-28-16-29/h2-4,6-10,13-16,23,32-33H,5,11-12H2,1H3/b9-8+