(2S)-2-(2,5-dimethoxyphenyl)-3-ethanoyl-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: (2S)-2-(2,5-dimethoxyphenyl)-3-ethanoyl-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: (2S)-3-acetyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one CAS Name: (2S)-3-acetyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-1-[2-(4-morpholin-4-iumyl)ethyl]-2H-pyrrol-5-one IUPAC Name: (2S)-3-acetyl-2-(2,5-dimethoxyphenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-acetyl-5-(2,5-dimethoxyphenyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-3-pyrrolin-2-one Formula: C20H27N2O6+ MolecularWeight: 391.43818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=C(C=CC(=C2)OC)OC)CC[NH+]3CCOCC3)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@H]1C2=C(C=CC(=C2)OC)OC)CC[NH+]3CCOCC3)O

InChI

InChI=1S/C20H26N2O6/c1-13(23)17-18(15-12-14(26-2)4-5-16(15)27-3)22(20(25)19(17)24)7-6-21-8-10-28-11-9-21/h4-5,12,18,24H,6-11H2,1-3H3/p+1/t18-/m0/s1