ethyl (2E)-2-[2-(4-bromophenyl)-2-oxidanylidene-1-phenylselanyl-ethylidene]pentanoate

Systemtic Name: ethyl (2E)-2-[2-(4-bromophenyl)-2-oxidanylidene-1-phenylselanyl-ethylidene]pentanoate Openeye Name: ethyl (2E)-2-[2-(4-bromophenyl)-2-oxo-1-phenylselanyl-ethylidene]pentanoate CAS Name: (2E)-2-[2-(4-bromophenyl)-2-oxo-1-(phenylseleno)ethylidene]pentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[2-(4-bromophenyl)-2-oxo-1-phenylselanylethylidene]pentanoate Traditional Name: (E)-4-(4-bromophenyl)-4-keto-3-(phenylseleno)-2-propyl-but-2-enoic acid ethyl ester Formula: C21H21BrO3Se MolecularWeight: 480.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(C(=O)C1=CC=C(C=C1)Br)[Se]C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC/C(=C(/C(=O)C1=CC=C(C=C1)Br)\[Se]C2=CC=CC=C2)/C(=O)OCC

InChI

InChI=1S/C21H21BrO3Se/c1-3-8-18(21(24)25-4-2)20(26-17-9-6-5-7-10-17)19(23)15-11-13-16(22)14-12-15/h5-7,9-14H,3-4,8H2,1-2H3/b20-18+