(5R)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-thiophen-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (5R)-4-[(3-methoxyphenyl)-oxidanyl-methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (5R)-4-[hydroxy-(3-methoxyphenyl)methylene]-1-(2-morpholin-4-ium-4-ylethyl)-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (5R)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-[2-(4-morpholin-4-iumyl)ethyl]-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (5R)-4-[hydroxy-(3-methoxyphenyl)methylidene]-1-(2-morpholin-4-ium-4-ylethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (5R)-4-[hydroxy-(3-methoxyphenyl)methylene]-1-(2-morpholin-4-ium-4-ylethyl)-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C22H25N2O5S+ MolecularWeight: 429.5093

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CS4)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=C2[C@@H](N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CS4)O

InChI

InChI=1S/C22H24N2O5S/c1-28-16-5-2-4-15(14-16)20(25)18-19(17-6-3-13-30-17)24(22(27)21(18)26)8-7-23-9-11-29-12-10-23/h2-6,13-14,19,25H,7-12H2,1H3/p+1/t19-/m0/s1