(2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: (2S,3S)-2-[(4-cyanophenyl)sulfonylamino]-3-hydroxy-butyrate Formula: C11H11N2O5S- MolecularWeight: 283.28044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NS(=O)(=O)C1=CC=C(C=C1)C#N)O

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5S/c1-7(14)10(11(15)16)13-19(17,18)9-4-2-8(6-12)3-5-9/h2-5,7,10,13-14H,1H3,(H,15,16)/p-1/t7-,10-/m0/s1