(4-methylphenyl) 3-(oxan-4-yl)azetidine-1-sulfonate

Systemtic Name: (4-methylphenyl) 3-(oxan-4-yl)azetidine-1-sulfonate Openeye Name: p-tolyl 3-tetrahydropyran-4-ylazetidine-1-sulfonate CAS Name: 3-(4-oxanyl)-1-azetidinesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3-(oxan-4-yl)azetidine-1-sulfonate Traditional Name: 3-tetrahydropyran-4-ylazetidine-1-sulfonic acid p-tolyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)N2CC(C2)C3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)N2CC(C2)C3CCOCC3

InChI

InChI=1S/C15H21NO4S/c1-12-2-4-15(5-3-12)20-21(17,18)16-10-14(11-16)13-6-8-19-9-7-13/h2-5,13-14H,6-11H2,1H3