methyl 5-(4-bromophenyl)-5-oxidanylidene-3-phenyl-pentanoate

Systemtic Name: methyl 5-(4-bromophenyl)-5-oxidanylidene-3-phenyl-pentanoate Openeye Name: methyl 5-(4-bromophenyl)-5-oxo-3-phenyl-pentanoate CAS Name: 5-(4-bromophenyl)-5-oxo-3-phenylpentanoic acid methyl ester IUPAC Name: methyl 5-(4-bromophenyl)-5-oxo-3-phenylpentanoate Traditional Name: 5-(4-bromophenyl)-5-keto-3-phenyl-valeric acid methyl ester Formula: C18H17BrO3 MolecularWeight: 361.22978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO3/c1-22-18(21)12-15(13-5-3-2-4-6-13)11-17(20)14-7-9-16(19)10-8-14/h2-10,15H,11-12H2,1H3