(4E)-5-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-1-phenethyl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-[(3-butoxyphenyl)-hydroxy-methylene]-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-[(3-butoxyphenyl)-hydroxymethylidene]-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-[(3-butoxyphenyl)-hydroxymethylidene]-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-[(3-butoxyphenyl)-hydroxy-methylene]-1-phenethyl-pyrrolidine-2,3-quinone Formula: C30H30BrNO6 MolecularWeight: 580.4663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC(=C(C(=C4)Br)O)OC)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC(=C(C(=C4)Br)O)OC)/O

InChI

InChI=1S/C30H30BrNO6/c1-3-4-15-38-22-12-8-11-20(16-22)27(33)25-26(21-17-23(31)28(34)24(18-21)37-2)32(30(36)29(25)35)14-13-19-9-6-5-7-10-19/h5-12,16-18,26,33-34H,3-4,13-15H2,1-2H3/b27-25+