(4E)-5-(4-butoxy-3-methoxy-phenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-oxidanyl-methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-oxidanyl-methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-hydroxy-methylene]pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxy-3-methoxyphenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxy-3-methoxyphenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-butoxy-3-methoxy-phenyl)-1-[3-(diethylamino)propyl]-4-[(2,5-dimethylphenyl)-hydroxy-methylene]pyrrolidine-2,3-quinone Formula: C31H42N2O5 MolecularWeight: 522.67558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C3=C(C=CC(=C3)C)C)O)C(=O)C(=O)N2CCCN(CC)CC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=C(C=CC(=C3)C)C)\O)/C(=O)C(=O)N2CCCN(CC)CC)OC

InChI

InChI=1S/C31H42N2O5/c1-7-10-18-38-25-15-14-23(20-26(25)37-6)28-27(29(34)24-19-21(4)12-13-22(24)5)30(35)31(36)33(28)17-11-16-32(8-2)9-3/h12-15,19-20,28,34H,7-11,16-18H2,1-6H3/b29-27+