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

Systemtic Name: tert-butyl 3-oxidanylidene-2-(phenylmethyl)pentanoate Openeye Name: tert-butyl 2-benzyl-3-oxo-pentanoate CAS Name: 3-oxo-2-(phenylmethyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-3-oxopentanoate Traditional Name: 2-benzyl-3-keto-valeric acid tert-butyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3/c1-5-14(17)13(15(18)19-16(2,3)4)11-12-9-7-6-8-10-12/h6-10,13H,5,11H2,1-4H3