(3aR,7aS)-3-(4-methylphenyl)sulfonyl-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one

Systemtic Name: (3aR,7aS)-3-(4-methylphenyl)sulfonyl-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one Openeye Name: (3aR,7aS)-3-(p-tolylsulfonyl)-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one CAS Name: (3aR,7aS)-3-(4-methylphenyl)sulfonyl-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one IUPAC Name: (3aR,7aS)-3-(4-methylphenyl)sulfonyl-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one Traditional Name: (3aR,7aS)-3-tosyl-3a,6,7,7a-tetrahydro-1,3-benzoxazol-2-one Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3C=CCCC3OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H]3C=CCC[C@@H]3OC2=O

InChI

InChI=1S/C14H15NO4S/c1-10-6-8-11(9-7-10)20(17,18)15-12-4-2-3-5-13(12)19-14(15)16/h2,4,6-9,12-13H,3,5H2,1H3/t12-,13+/m1/s1