tert-butyl 2-bromanyl-3-oxidanylidene-2-(phenylmethyl)pentanoate

Systemtic Name: tert-butyl 2-bromanyl-3-oxidanylidene-2-(phenylmethyl)pentanoate Openeye Name: tert-butyl 2-benzyl-2-bromo-3-oxo-pentanoate CAS Name: 2-bromo-3-oxo-2-(phenylmethyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-2-bromo-3-oxopentanoate Traditional Name: 2-benzyl-2-bromo-3-keto-valeric acid tert-butyl ester Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrO3/c1-5-13(18)16(17,14(19)20-15(2,3)4)11-12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3