[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-ethylhexanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-ethylhexanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OCC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCC(CC)C(=O)OCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C16H21BrO3/c1-3-5-6-12(4-2)16(19)20-11-15(18)13-7-9-14(17)10-8-13/h7-10,12H,3-6,11H2,1-2H3