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dimethyl (2S)-2-(phenylmethyl)butanedioate

dimethyl (2S)-2-(phenylmethyl)butanedioate

Systemtic Name:dimethyl (2S)-2-(phenylmethyl)butanedioate
Openeye Name:dimethyl (2S)-2-benzylbutanedioate
CAS Name:(2S)-2-(phenylmethyl)butanedioic acid dimethyl ester
IUPAC Name:dimethyl (2S)-2-benzylbutanedioate
Traditional Name:(2S)-2-benzylsuccinic acid dimethyl ester
Formula: C13H16O4
MolecularWeight: 236.26374
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

COC(=O)C[C@H](CC1=CC=CC=C1)C(=O)OC


InChI

InChI=1S/C13H16O4/c1-16-12(14)9-11(13(15)17-2)8-10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3/t11-/m0/s1


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