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methyl 3-oxidanylidene-2-(phenylmethyl)hexanoate

methyl 3-oxidanylidene-2-(phenylmethyl)hexanoate

Systemtic Name:methyl 3-oxidanylidene-2-(phenylmethyl)hexanoate
Openeye Name:methyl 2-benzyl-3-oxo-hexanoate
CAS Name:3-oxo-2-(phenylmethyl)hexanoic acid methyl ester
IUPAC Name:methyl 2-benzyl-3-oxohexanoate
Traditional Name:2-benzyl-3-keto-hexanoic acid methyl ester
Formula: C14H18O3
MolecularWeight: 234.29092
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H18O3/c1-3-7-13(15)12(14(16)17-2)10-11-8-5-4-6-9-11/h4-6,8-9,12H,3,7,10H2,1-2H3


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