methyl benzoate; 2-oxidanyl-1,2-diphenyl-ethanone

Systemtic Name: methyl benzoate; 2-oxidanyl-1,2-diphenyl-ethanone Openeye Name: 2-hydroxy-1,2-diphenyl-ethanone; methyl benzoate CAS Name: benzoic acid methyl ester; 2-hydroxy-1,2-diphenylethanone IUPAC Name: 2-hydroxy-1,2-diphenylethanone; methyl benzoate Traditional Name: benzoic acid methyl ester; benzoin Formula: C22H20O4 MolecularWeight: 348.3918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1.C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1.C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C14H12O2.C8H8O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;1-10-8(9)7-5-3-2-4-6-7/h1-10,13,15H;2-6H,1H3