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2-[(2S)-2-oxidanyl-4-phenylmethoxy-butyl]propanedioic acid

2-[(2S)-2-oxidanyl-4-phenylmethoxy-butyl]propanedioic acid

Systemtic Name:2-[(2S)-2-oxidanyl-4-phenylmethoxy-butyl]propanedioic acid
Openeye Name:2-[(2S)-4-benzyloxy-2-hydroxy-butyl]propanedioic acid
CAS Name:2-[(2S)-2-hydroxy-4-phenylmethoxybutyl]propanedioic acid
IUPAC Name:2-[(2S)-2-hydroxy-4-phenylmethoxybutyl]propanedioic acid
Traditional Name:2-[(2S)-4-benzoxy-2-hydroxy-butyl]malonic acid
Formula: C14H18O6
MolecularWeight: 282.28912
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCC(CC(C(=O)O)C(=O)O)O


Isomeric SMILES

C1=CC=C(C=C1)COCC[C@H](CC(C(=O)O)C(=O)O)O


InChI

InChI=1S/C14H18O6/c15-11(8-12(13(16)17)14(18)19)6-7-20-9-10-4-2-1-3-5-10/h1-5,11-12,15H,6-9H2,(H,16,17)(H,18,19)/t11-/m1/s1


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