[4-(4-fluorophenyl)-2-oxidanyl-cyclohexa-1,4-dien-1-yl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide

Systemtic Name: [4-(4-fluorophenyl)-2-oxidanyl-cyclohexa-1,4-dien-1-yl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide Openeye Name: [4-(4-fluorophenyl)-2-hydroxy-cyclohexa-1,4-dien-1-yl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide CAS Name: [4-(4-fluorophenyl)-2-hydroxy-1-cyclohexa-1,4-dienyl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide IUPAC Name: [4-(4-fluorophenyl)-2-hydroxycyclohexa-1,4-dien-1-yl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide Traditional Name: [4-(4-fluorophenyl)-2-hydroxy-cyclohexa-1,4-dien-1-yl]-propoxy-(2H-pyridin-1-yl)methanesulfonamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=C(CC(=CC1)C2=CC=C(C=C2)F)O)(N3CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CCCOC(C1=C(CC(=CC1)C2=CC=C(C=C2)F)O)(N3CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C21H25FN2O4S/c1-2-14-28-21(29(23,26)27,24-12-4-3-5-13-24)19-11-8-17(15-20(19)25)16-6-9-18(22)10-7-16/h3-10,12,25H,2,11,13-15H2,1H3,(H2,23,26,27)