(4E)-4-[(4-bromophenyl)-oxidanyl-methylidene]-5-(3-pentoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(4-bromophenyl)-oxidanyl-methylidene]-5-(3-pentoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(4-bromophenyl)-hydroxy-methylene]-5-(3-pentoxyphenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3-pentoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3-pentoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(3-amoxyphenyl)-4-[(4-bromophenyl)-hydroxy-methylene]pyrrolidine-2,3-quinone Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C2C(=C(C3=CC=C(C=C3)Br)O)C(=O)C(=O)N2

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C2/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C(=O)N2

InChI

InChI=1S/C22H22BrNO4/c1-2-3-4-12-28-17-7-5-6-15(13-17)19-18(21(26)22(27)24-19)20(25)14-8-10-16(23)11-9-14/h5-11,13,19,25H,2-4,12H2,1H3,(H,24,27)/b20-18+