(4E)-1-[3-(dimethylamino)propyl]-5-(2-ethoxyphenyl)-4-[[3-methyl-4-(2-methylpropoxy)phenyl]-oxidanyl-methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-[3-(dimethylamino)propyl]-5-(2-ethoxyphenyl)-4-[[3-methyl-4-(2-methylpropoxy)phenyl]-oxidanyl-methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-1-[3-(dimethylamino)propyl]-5-(2-ethoxyphenyl)-4-[hydroxy-(4-isobutoxy-3-methyl-phenyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-1-[3-(dimethylamino)propyl]-5-(2-ethoxyphenyl)-4-[hydroxy-[3-methyl-4-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-1-[3-(dimethylamino)propyl]-5-(2-ethoxyphenyl)-4-[hydroxy-[3-methyl-4-(2-methylpropoxy)phenyl]methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(4-isobutoxy-3-methyl-phenyl)methylene]-5-o-phenetyl-pyrrolidine-2,3-quinone Formula: C29H38N2O5 MolecularWeight: 494.62242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(=C(C3=CC(=C(C=C3)OCC(C)C)C)O)C(=O)C(=O)N2CCCN(C)C

Isomeric SMILES

CCOC1=CC=CC=C1C2/C(=C(/C3=CC(=C(C=C3)OCC(C)C)C)\O)/C(=O)C(=O)N2CCCN(C)C

InChI

InChI=1S/C29H38N2O5/c1-7-35-24-12-9-8-11-22(24)26-25(28(33)29(34)31(26)16-10-15-30(5)6)27(32)21-13-14-23(20(4)17-21)36-18-19(2)3/h8-9,11-14,17,19,26,32H,7,10,15-16,18H2,1-6H3/b27-25+