3-[(2R)-2-(4-chlorophenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propyl-(2-hydroxyethyl)azanium

Systemtic Name: 3-[(2R)-2-(4-chlorophenyl)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propyl-(2-hydroxyethyl)azanium Openeye Name: 3-[(2R)-3-acetyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]propyl-(2-hydroxyethyl)ammonium CAS Name: 3-[(2R)-3-acetyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]propyl-(2-hydroxyethyl)ammonium IUPAC Name: 3-[(2R)-3-acetyl-2-(4-chlorophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]propyl-(2-hydroxyethyl)azanium Traditional Name: 3-[(2R)-3-acetyl-2-(4-chlorophenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]propyl-(2-hydroxyethyl)ammonium Formula: C17H22ClN2O4+ MolecularWeight: 353.82058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN2O4/c1-11(22)14-15(12-3-5-13(18)6-4-12)20(17(24)16(14)23)9-2-7-19-8-10-21/h3-6,15,19,21,23H,2,7-10H2,1H3/p+1/t15-/m1/s1