(2-oxidanylidene-1,2-diphenyl-ethyl) 6-bromanyl-7-oxidanyl-7-phenyl-heptanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 6-bromanyl-7-oxidanyl-7-phenyl-heptanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 6-bromo-7-oxidanyl-7-phenyl-heptanoate CAS Name: 6-bromo-7-oxidanyl-7-phenylheptanoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 6-bromo-7-oxidanyl-7-phenylheptanoate Traditional Name: 6-bromo-7-oxidanyl-7-phenyl-enanthic acid desyl ester Formula: C27H27BrO4 MolecularWeight: 496.404611

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C(C(CCCCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)Br)[17OH]

InChI

InChI=1S/C27H27BrO4/c28-23(25(30)20-12-4-1-5-13-20)18-10-11-19-24(29)32-27(22-16-8-3-9-17-22)26(31)21-14-6-2-7-15-21/h1-9,12-17,23,25,27,30H,10-11,18-19H2/i30+1