(2R)-4-methylsulfonyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate

Systemtic Name: (2R)-4-methylsulfonyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate Openeye Name: (2R)-4-methylsulfonyl-2-[[(E)-styryl]sulfonylamino]butanoate CAS Name: (2R)-4-methylsulfonyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate IUPAC Name: (2R)-4-methylsulfonyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate Traditional Name: (2R)-4-mesyl-2-[[(E)-styryl]sulfonylamino]butyrate Formula: C13H16NO6S2- MolecularWeight: 346.39924

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)[O-])NS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO6S2/c1-21(17,18)9-8-12(13(15)16)14-22(19,20)10-7-11-5-3-2-4-6-11/h2-7,10,12,14H,8-9H2,1H3,(H,15,16)/p-1/b10-7+/t12-/m1/s1