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

Systemtic Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-yl-pyrrolidine-2,3-dione Openeye Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(3-pyridyl)pyrrolidine-2,3-dione CAS Name: (5R)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-[3-(4-morpholinyl)propyl]-5-(3-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (5R)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione Traditional Name: (5R)-4-[(4-butoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(3-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=CN=CC=C4)O)C

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O5/c1-3-4-15-36-23-9-8-21(18-20(23)2)26(32)24-25(22-7-5-10-29-19-22)31(28(34)27(24)33)12-6-11-30-13-16-35-17-14-30/h5,7-10,18-19,25,32H,3-4,6,11-17H2,1-2H3/t25-/m1/s1