4-methyl-5-(phenylmethyl)-1,3-oxathiane-2,6-dione

Systemtic Name: 4-methyl-5-(phenylmethyl)-1,3-oxathiane-2,6-dione Openeye Name: 5-benzyl-4-methyl-1,3-oxathiane-2,6-dione CAS Name: 4-methyl-5-(phenylmethyl)-1,3-oxathiane-2,6-dione IUPAC Name: 5-benzyl-4-methyl-1,3-oxathiane-2,6-dione Traditional Name: 5-benzyl-4-methyl-1,3-oxathiane-2,6-quinone Formula: C12H12O3S MolecularWeight: 236.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)OC(=O)S1)CC2=CC=CC=C2

Isomeric SMILES

CC1C(C(=O)OC(=O)S1)CC2=CC=CC=C2

InChI

InChI=1S/C12H12O3S/c1-8-10(11(13)15-12(14)16-8)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3