2-(4-fluorophenyl)-1-[2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]-N,3-diphenyl-5-propan-2-yl-pyrrol-1-ium-1-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-1-[2-(4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]-N,3-diphenyl-5-propan-2-yl-pyrrol-1-ium-1-carboxamide Openeye Name: 2-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-tetrahydropyran-2-yl)ethyl]-5-isopropyl-N,3-diphenyl-pyrrol-1-ium-1-carboxamide CAS Name: 2-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxo-2-oxanyl)ethyl]-N,3-diphenyl-5-propan-2-yl-1-pyrrol-1-iumcarboxamide IUPAC Name: 2-(4-fluorophenyl)-1-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-N,3-diphenyl-5-propan-2-ylpyrrol-1-ium-1-carboxamide Traditional Name: 2-(4-fluorophenyl)-1-[2-(4-hydroxy-6-keto-tetrahydropyran-2-yl)ethyl]-5-isopropyl-N,3-diphenyl-pyrrol-1-ium-1-carboxamide Formula: C33H34FN2O4+ MolecularWeight: 541.632463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C([N+]1(CCC2CC(CC(=O)O2)O)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC(=C([N+]1(CCC2CC(CC(=O)O2)O)C(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C33H33FN2O4/c1-22(2)30-21-29(23-9-5-3-6-10-23)32(24-13-15-25(34)16-14-24)36(30,33(39)35-26-11-7-4-8-12-26)18-17-28-19-27(37)20-31(38)40-28/h3-16,21-22,27-28,37H,17-20H2,1-2H3/p+1