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

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(3-methoxy-4-oxidanyl-phenyl)-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-phenethyl-pyrrolidine-2,3-quinone Formula: C30H31NO6 MolecularWeight: 501.57024

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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)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)O)OC)/O

InChI

InChI=1S/C30H31NO6/c1-3-4-17-37-23-12-8-11-22(18-23)28(33)26-27(21-13-14-24(32)25(19-21)36-2)31(30(35)29(26)34)16-15-20-9-6-5-7-10-20/h5-14,18-19,27,32-33H,3-4,15-17H2,1-2H3/b28-26+