methyl 2-[2-(4-bromophenyl)ethanoyl]-3-oxidanylidene-pentanoate

Systemtic Name: methyl 2-[2-(4-bromophenyl)ethanoyl]-3-oxidanylidene-pentanoate Openeye Name: methyl 2-[2-(4-bromophenyl)acetyl]-3-oxo-pentanoate CAS Name: 2-[2-(4-bromophenyl)-1-oxoethyl]-3-oxopentanoic acid methyl ester IUPAC Name: methyl 2-[2-(4-bromophenyl)acetyl]-3-oxopentanoate Traditional Name: 2-[2-(4-bromophenyl)acetyl]-3-keto-valeric acid methyl ester Formula: C14H15BrO4 MolecularWeight: 327.1705

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(=O)CC1=CC=C(C=C1)Br)C(=O)OC

Isomeric SMILES

CCC(=O)C(C(=O)CC1=CC=C(C=C1)Br)C(=O)OC

InChI

InChI=1S/C14H15BrO4/c1-3-11(16)13(14(18)19-2)12(17)8-9-4-6-10(15)7-5-9/h4-7,13H,3,8H2,1-2H3