6-[(2R)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]hexanoic acid

Systemtic Name: 6-[(2R)-3-ethanoyl-4-oxidanyl-5-oxidanylidene-2-phenyl-2H-pyrrol-1-yl]hexanoic acid Openeye Name: 6-[(2R)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]hexanoic acid CAS Name: 6-[(2R)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]hexanoic acid IUPAC Name: 6-[(2R)-3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]hexanoic acid Traditional Name: 6-[(5R)-4-acetyl-3-hydroxy-2-keto-5-phenyl-3-pyrrolin-1-yl]hexanoic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=CC=C2)CCCCCC(=O)O)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N([C@@H]1C2=CC=CC=C2)CCCCCC(=O)O)O

InChI

InChI=1S/C18H21NO5/c1-12(20)15-16(13-8-4-2-5-9-13)19(18(24)17(15)23)11-7-3-6-10-14(21)22/h2,4-5,8-9,16,23H,3,6-7,10-11H2,1H3,(H,21,22)/t16-/m1/s1