(4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(3,4-dimethoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(3,4-dimethoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3,4-dimethoxyphenyl)-1-(4-pyridylmethyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3,4-dimethoxyphenyl)-1-(4-pyridylmethyl)pyrrolidine-2,3-quinone Formula: C29H30N2O6 MolecularWeight: 502.5583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CC3=CC=NC=C3)C4=CC(=C(C=C4)OC)OC)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CC3=CC=NC=C3)C4=CC(=C(C=C4)OC)OC)/O

InChI

InChI=1S/C29H30N2O6/c1-4-5-15-37-22-8-6-7-21(16-22)27(32)25-26(20-9-10-23(35-2)24(17-20)36-3)31(29(34)28(25)33)18-19-11-13-30-14-12-19/h6-14,16-17,26,32H,4-5,15,18H2,1-3H3/b27-25+