2-[(3-cyanophenyl)methylsulfonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(3-cyanophenyl)methylsulfonylamino]-3-oxidanyl-propanoic acid Openeye Name: 2-[(3-cyanophenyl)methylsulfonylamino]-3-hydroxy-propanoic acid CAS Name: 2-[(3-cyanophenyl)methylsulfonylamino]-3-hydroxypropanoic acid IUPAC Name: 2-[(3-cyanophenyl)methylsulfonylamino]-3-hydroxypropanoic acid Traditional Name: 2-[(3-cyanobenzyl)sulfonylamino]-3-hydroxy-propionic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS(=O)(=O)NC(CO)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CS(=O)(=O)NC(CO)C(=O)O)C#N

InChI

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