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

Systemtic Name: (5S)-4-[(2-methyl-4-propan-2-yloxy-phenyl)-oxidanyl-methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-yl-pyrrolidine-2,3-dione Openeye Name: (5S)-4-[hydroxy-(4-isopropoxy-2-methyl-phenyl)methylene]-1-(3-morpholinopropyl)-5-(3-pyridyl)pyrrolidine-2,3-dione CAS Name: (5S)-4-[hydroxy-(2-methyl-4-propan-2-yloxyphenyl)methylidene]-1-[3-(4-morpholinyl)propyl]-5-(3-pyridinyl)pyrrolidine-2,3-dione IUPAC Name: (5S)-4-[hydroxy-(2-methyl-4-propan-2-yloxyphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione Traditional Name: (5S)-4-[hydroxy-(4-isopropoxy-2-methyl-phenyl)methylene]-1-(3-morpholinopropyl)-5-(3-pyridyl)pyrrolidine-2,3-quinone Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CN=CC=C4)O

Isomeric SMILES

CC1=C(C=CC(=C1)OC(C)C)C(=C2[C@@H](N(C(=O)C2=O)CCCN3CCOCC3)C4=CN=CC=C4)O

InChI

InChI=1S/C27H33N3O5/c1-18(2)35-21-7-8-22(19(3)16-21)25(31)23-24(20-6-4-9-28-17-20)30(27(33)26(23)32)11-5-10-29-12-14-34-15-13-29/h4,6-9,16-18,24,31H,5,10-15H2,1-3H3/t24-/m0/s1