(5S)-1-(2-diethylaminoethyl)-4-[(4-methoxy-2-oxidanyl-phenyl)-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (5S)-1-(2-diethylaminoethyl)-4-[(4-methoxy-2-oxidanyl-phenyl)-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (5S)-1-(2-diethylaminoethyl)-4-[hydroxy-(2-hydroxy-4-methoxy-phenyl)methylene]-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (5S)-1-(2-diethylaminoethyl)-4-[hydroxy-(2-hydroxy-4-methoxyphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (5S)-1-(2-diethylaminoethyl)-4-[hydroxy-(2-hydroxy-4-methoxyphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (5S)-1-(2-diethylaminoethyl)-4-[hydroxy-(2-hydroxy-4-methoxy-phenyl)methylene]-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C22H26N2O5S MolecularWeight: 430.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(C(=C(C2=C(C=C(C=C2)OC)O)O)C(=O)C1=O)C3=CC=CS3

Isomeric SMILES

CCN(CC)CCN1[C@@H](C(=C(C2=C(C=C(C=C2)OC)O)O)C(=O)C1=O)C3=CC=CS3

InChI

InChI=1S/C22H26N2O5S/c1-4-23(5-2)10-11-24-19(17-7-6-12-30-17)18(21(27)22(24)28)20(26)15-9-8-14(29-3)13-16(15)25/h6-9,12-13,19,25-26H,4-5,10-11H2,1-3H3/t19-/m1/s1