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(2R,3S)-3-azanyl-2-oxidanyl-2-phenethyl-butanedioic acid

(2R,3S)-3-azanyl-2-oxidanyl-2-phenethyl-butanedioic acid

Systemtic Name:(2R,3S)-3-azanyl-2-oxidanyl-2-phenethyl-butanedioic acid
Openeye Name:(2R,3S)-3-amino-2-hydroxy-2-phenethyl-butanedioic acid
CAS Name:(2R,3S)-3-amino-2-hydroxy-2-phenethylbutanedioic acid
IUPAC Name:(2R,3S)-3-amino-2-hydroxy-2-phenethylbutanedioic acid
Traditional Name:(2R,3S)-3-amino-2-hydroxy-2-phenethyl-succinic acid
Formula: C12H15NO5
MolecularWeight: 253.2512
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(C(=O)O)N)(C(=O)O)O


Isomeric SMILES

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


InChI

InChI=1S/C12H15NO5/c13-9(10(14)15)12(18,11(16)17)7-6-8-4-2-1-3-5-8/h1-5,9,18H,6-7,13H2,(H,14,15)(H,16,17)/t9-,12-/m1/s1


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