(5R)-4-[(4-butoxy-3-methyl-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione

Systemtic Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-yl-pyrrolidine-2,3-dione Openeye Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(4-pyridyl)pyrrolidine-2,3-dione CAS Name: (5R)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-[3-(4-morpholinyl)propyl]-5-pyridin-4-ylpyrrolidine-2,3-dione IUPAC Name: (5R)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-4-ylpyrrolidine-2,3-dione Traditional Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(4-pyridyl)pyrrolidine-2,3-quinone Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=NC=C4)O)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=C2[C@H](N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=NC=C4)O)C

InChI

InChI=1S/C28H35N3O5/c1-3-4-16-36-23-7-6-22(19-20(23)2)26(32)24-25(21-8-10-29-11-9-21)31(28(34)27(24)33)13-5-12-30-14-17-35-18-15-30/h6-11,19,25,32H,3-5,12-18H2,1-2H3/t25-/m1/s1