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

Systemtic Name: 2-[(2R)-3-ethanoyl-2-(4-methoxyphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Openeye Name: 2-[(2R)-3-acetyl-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium CAS Name: 2-[(2R)-3-acetyl-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)ammonium IUPAC Name: 2-[(2R)-3-acetyl-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2H-pyrrol-1-yl]ethyl-(2-hydroxyethyl)azanium Traditional Name: 2-[(5R)-4-acetyl-3-hydroxy-2-keto-5-(4-methoxyphenyl)-3-pyrrolin-1-yl]ethyl-(2-hydroxyethyl)ammonium Formula: C17H23N2O5+ MolecularWeight: 335.37492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O5/c1-11(21)14-15(12-3-5-13(24-2)6-4-12)19(17(23)16(14)22)9-7-18-8-10-20/h3-6,15,18,20,22H,7-10H2,1-2H3/p+1/t15-/m1/s1