5-[2-tert-butyl-5-(4-fluorophenyl)pyrrol-1-yl]-3-ethyl-4-oxidanyl-oxan-2-one

Systemtic Name: 5-[2-tert-butyl-5-(4-fluorophenyl)pyrrol-1-yl]-3-ethyl-4-oxidanyl-oxan-2-one Openeye Name: 5-[2-tert-butyl-5-(4-fluorophenyl)pyrrol-1-yl]-3-ethyl-4-hydroxy-tetrahydropyran-2-one CAS Name: 5-[2-tert-butyl-5-(4-fluorophenyl)-1-pyrrolyl]-3-ethyl-4-hydroxy-2-oxanone IUPAC Name: 5-[2-tert-butyl-5-(4-fluorophenyl)pyrrol-1-yl]-3-ethyl-4-hydroxyoxan-2-one Traditional Name: 5-[2-tert-butyl-5-(4-fluorophenyl)pyrrol-1-yl]-3-ethyl-4-hydroxy-tetrahydropyran-2-one Formula: C21H26FNO3 MolecularWeight: 359.434443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(COC1=O)N2C(=CC=C2C(C)(C)C)C3=CC=C(C=C3)F)O

Isomeric SMILES

CCC1C(C(COC1=O)N2C(=CC=C2C(C)(C)C)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C21H26FNO3/c1-5-15-19(24)17(12-26-20(15)25)23-16(10-11-18(23)21(2,3)4)13-6-8-14(22)9-7-13/h6-11,15,17,19,24H,5,12H2,1-4H3