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(2R,3S)-2-ethyl-3-[(4-methylphenyl)sulfonylamino]butanedioic acid

(2R,3S)-2-ethyl-3-[(4-methylphenyl)sulfonylamino]butanedioic acid

Systemtic Name:(2R,3S)-2-ethyl-3-[(4-methylphenyl)sulfonylamino]butanedioic acid
Openeye Name:(2R,3S)-2-ethyl-3-(p-tolylsulfonylamino)butanedioic acid
CAS Name:(2R,3S)-2-ethyl-3-[(4-methylphenyl)sulfonylamino]butanedioic acid
IUPAC Name:(2R,3S)-2-ethyl-3-[(4-methylphenyl)sulfonylamino]butanedioic acid
Traditional Name:(2R,3S)-2-ethyl-3-(tosylamino)succinic acid
Formula: C13H17NO6S
MolecularWeight: 315.34218
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H17NO6S/c1-3-10(12(15)16)11(13(17)18)14-21(19,20)9-6-4-8(2)5-7-9/h4-7,10-11,14H,3H2,1-2H3,(H,15,16)(H,17,18)/t10-,11+/m1/s1


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