ethyl 2-methoxysulfonylbenzoate; 3-methyloxet-2-one; 2-oxidanyl-1,2-diphenyl-ethanone

Systemtic Name: ethyl 2-methoxysulfonylbenzoate; 3-methyloxet-2-one; 2-oxidanyl-1,2-diphenyl-ethanone Openeye Name: ethyl 2-methoxysulfonylbenzoate; 2-hydroxy-1,2-diphenyl-ethanone; 3-methyloxet-2-one CAS Name: 2-hydroxy-1,2-diphenylethanone; 2-methoxysulfonylbenzoic acid ethyl ester; 3-methyl-2-oxetone IUPAC Name: ethyl 2-methoxysulfonylbenzoate; 2-hydroxy-1,2-diphenylethanone; 3-methyloxet-2-one Traditional Name: benzoin; 2-methoxysulfonylbenzoic acid ethyl ester; 3-methyloxet-2-one Formula: C28H28O9S MolecularWeight: 540.58152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1S(=O)(=O)OC.CC1=COC1=O.C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1S(=O)(=O)OC.CC1=COC1=O.C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C14H12O2.C10H12O5S.C4H4O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-3-15-10(11)8-6-4-5-7-9(8)16(12,13)14-2;1-3-2-6-4(3)5/h1-10,13,15H;4-7H,3H2,1-2H3;2H,1H3