(4E)-5-(4-tert-butylphenyl)-1-(3-imidazol-1-ylpropyl)-4-[[4-[(3-methylphenyl)methoxy]phenyl]-oxidanyl-methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-tert-butylphenyl)-1-(3-imidazol-1-ylpropyl)-4-[[4-[(3-methylphenyl)methoxy]phenyl]-oxidanyl-methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-tert-butylphenyl)-4-[hydroxy-[4-(m-tolylmethoxy)phenyl]methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-tert-butylphenyl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-[3-(1-imidazolyl)propyl]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-tert-butylphenyl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-tert-butylphenyl)-4-[hydroxy-[4-(3-methylbenzyl)oxyphenyl]methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-quinone Formula: C35H37N3O4 MolecularWeight: 563.68598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCCN4C=CN=C4)C5=CC=C(C=C5)C(C)(C)C)O

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C(=C\3/C(N(C(=O)C3=O)CCCN4C=CN=C4)C5=CC=C(C=C5)C(C)(C)C)/O

InChI

InChI=1S/C35H37N3O4/c1-24-7-5-8-25(21-24)22-42-29-15-11-27(12-16-29)32(39)30-31(26-9-13-28(14-10-26)35(2,3)4)38(34(41)33(30)40)19-6-18-37-20-17-36-23-37/h5,7-17,20-21,23,31,39H,6,18-19,22H2,1-4H3/b32-30+