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

Systemtic Name: methyl 5-(4-bromophenyl)-3-methyl-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(4-bromophenyl)-3-methyl-5-oxo-pentanoate CAS Name: 5-(4-bromophenyl)-3-methyl-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(4-bromophenyl)-3-methyl-5-oxopentanoate Traditional Name: 5-(4-bromophenyl)-5-keto-3-methyl-valeric acid methyl ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO3/c1-9(8-13(16)17-2)7-12(15)10-3-5-11(14)6-4-10/h3-6,9H,7-8H2,1-2H3