2-[(2R)-2-(2,4-dimethoxyphenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium

Systemtic Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Openeye Name: 2-[(2R)-3-acetyl-2-(2,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium CAS Name: 2-[(2R)-3-acetyl-2-(2,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium IUPAC Name: 2-[(2R)-3-acetyl-2-(2,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Traditional Name: 2-[(2R)-3-acetyl-2-(2,4-dimethoxyphenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]ethyl-(2-hydroxyethyl)ammonium Formula: C18H25N2O6+ MolecularWeight: 365.4009

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=C(C=C(C=C2)OC)OC)CC[NH2+]CCO)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=C(C=C(C=C2)OC)OC)CC[NH2+]CCO)O

InChI

InChI=1S/C18H24N2O6/c1-11(22)15-16(13-5-4-12(25-2)10-14(13)26-3)20(18(24)17(15)23)8-6-19-7-9-21/h4-5,10,16,19,21,23H,6-9H2,1-3H3/p+1/t16-/m1/s1