(2-oxidanylidene-1,2-diphenyl-ethyl) 3-bromanyl-4-methyl-benzoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 3-bromanyl-4-methyl-benzoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid desyl ester Formula: C22H17BrO3 MolecularWeight: 409.27258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C22H17BrO3/c1-15-12-13-18(14-19(15)23)22(25)26-21(17-10-6-3-7-11-17)20(24)16-8-4-2-5-9-16/h2-14,21H,1H3