2-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-1-(3-morpholin-4-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-morpholin-4-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-morpholinopropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-hydroxy-1-[3-(4-morpholinyl)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-morpholin-4-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-morpholinopropyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C27H29BrN2O6 MolecularWeight: 557.43296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCCN3CCOCC3)O)C(=O)C=CC4=CC=CC=C4)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=C(C(=O)N2CCCN3CCOCC3)O)C(=O)/C=C/C4=CC=CC=C4)Br)O

InChI

InChI=1S/C27H29BrN2O6/c1-35-22-17-19(16-20(28)25(22)32)24-23(21(31)9-8-18-6-3-2-4-7-18)26(33)27(34)30(24)11-5-10-29-12-14-36-15-13-29/h2-4,6-9,16-17,24,32-33H,5,10-15H2,1H3/b9-8+