6-[5-(4-fluorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]pyridine-3-sulfonamide

Systemtic Name: 6-[5-(4-fluorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]pyridine-3-sulfonamide Openeye Name: 6-[5-(4-fluorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]pyridine-3-sulfonamide CAS Name: 6-[5-(4-fluorophenyl)-3,3-bis(hydroxymethyl)-1-cyclopenta-1,4-dienyl]-3-pyridinesulfonamide IUPAC Name: 6-[5-(4-fluorophenyl)-3,3-bis(hydroxymethyl)cyclopenta-1,4-dien-1-yl]pyridine-3-sulfonamide Traditional Name: 6-[5-(4-fluorophenyl)-3,3-dimethylol-cyclopenta-1,4-dien-1-yl]pyridine-3-sulfonamide Formula: C18H17FN2O4S MolecularWeight: 376.401983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(C=C2C3=NC=C(C=C3)S(=O)(=O)N)(CO)CO)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(C=C2C3=NC=C(C=C3)S(=O)(=O)N)(CO)CO)F

InChI

InChI=1S/C18H17FN2O4S/c19-13-3-1-12(2-4-13)15-7-18(10-22,11-23)8-16(15)17-6-5-14(9-21-17)26(20,24)25/h1-9,22-23H,10-11H2,(H2,20,24,25)