(4E)-5-(4-butoxy-3-methoxy-phenyl)-4-[(3-ethoxyphenyl)-oxidanyl-methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-4-[(3-ethoxyphenyl)-oxidanyl-methylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-4-[(3-ethoxyphenyl)-hydroxy-methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxy-3-methoxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(3-pyridinylmethyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxy-3-methoxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-4-[hydroxy(m-phenetyl)methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-quinone Formula: C30H32N2O6 MolecularWeight: 516.58488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=CC=C3)OCC)O)C(=O)C(=O)N2CC4=CN=CC=C4)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC(=CC=C3)OCC)\O)/C(=O)C(=O)N2CC4=CN=CC=C4)OC

InChI

InChI=1S/C30H32N2O6/c1-4-6-15-38-24-13-12-21(17-25(24)36-3)27-26(28(33)22-10-7-11-23(16-22)37-5-2)29(34)30(35)32(27)19-20-9-8-14-31-18-20/h7-14,16-18,27,33H,4-6,15,19H2,1-3H3/b28-26+