6-bromanyl-3-(4-methylphenyl)sulfonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one

Systemtic Name: 6-bromanyl-3-(4-methylphenyl)sulfonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Openeye Name: 6-bromo-3-(p-tolylsulfonyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one CAS Name: 6-bromo-3-(4-methylphenyl)sulfonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one IUPAC Name: 6-bromo-3-(4-methylphenyl)sulfonyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Traditional Name: 6-bromo-3-tosyl-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-2-one Formula: C14H16BrNO4S MolecularWeight: 374.25014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3CCC(CC3OC2=O)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3CCC(CC3OC2=O)Br

InChI

InChI=1S/C14H16BrNO4S/c1-9-2-5-11(6-3-9)21(18,19)16-12-7-4-10(15)8-13(12)20-14(16)17/h2-3,5-6,10,12-13H,4,7-8H2,1H3