(2S)-2-[(4-cyanophenyl)methylsulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[(4-cyanophenyl)methylsulfonylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-2-[(4-cyanophenyl)methylsulfonylamino]-3-hydroxy-propanoate CAS Name: (2S)-2-[(4-cyanophenyl)methylsulfonylamino]-3-hydroxypropanoate IUPAC Name: (2S)-2-[(4-cyanophenyl)methylsulfonylamino]-3-hydroxypropanoate Traditional Name: (2S)-2-[(4-cyanobenzyl)sulfonylamino]-3-hydroxy-propionate Formula: C11H11N2O5S- MolecularWeight: 283.28044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)NC(CO)C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)N[C@@H](CO)C(=O)[O-])C#N

InChI

InChI=1S/C11H12N2O5S/c12-5-8-1-3-9(4-2-8)7-19(17,18)13-10(6-14)11(15)16/h1-4,10,13-14H,6-7H2,(H,15,16)/p-1/t10-/m0/s1