[1-(hydroxymethyl)-3-(4-methylsulfonylphenyl)-4-pyridin-4-yl-cyclopent-3-en-1-yl]methanol

Systemtic Name: [1-(hydroxymethyl)-3-(4-methylsulfonylphenyl)-4-pyridin-4-yl-cyclopent-3-en-1-yl]methanol Openeye Name: [1-(hydroxymethyl)-3-(4-methylsulfonylphenyl)-4-(4-pyridyl)cyclopent-3-en-1-yl]methanol CAS Name: [1-(hydroxymethyl)-3-(4-methylsulfonylphenyl)-4-pyridin-4-yl-1-cyclopent-3-enyl]methanol IUPAC Name: [1-(hydroxymethyl)-3-(4-methylsulfonylphenyl)-4-pyridin-4-ylcyclopent-3-en-1-yl]methanol Traditional Name: [3-(4-mesylphenyl)-1-methylol-4-(4-pyridyl)cyclopent-3-en-1-yl]methanol Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC=NC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC=NC=C3

InChI

InChI=1S/C19H21NO4S/c1-25(23,24)16-4-2-14(3-5-16)17-10-19(12-21,13-22)11-18(17)15-6-8-20-9-7-15/h2-9,21-22H,10-13H2,1H3