4-[(3-cyanophenyl)methylsulfonylamino]butanoic acid

Systemtic Name: 4-[(3-cyanophenyl)methylsulfonylamino]butanoic acid Openeye Name: 4-[(3-cyanophenyl)methylsulfonylamino]butanoic acid CAS Name: 4-[(3-cyanophenyl)methylsulfonylamino]butanoic acid IUPAC Name: 4-[(3-cyanophenyl)methylsulfonylamino]butanoic acid Traditional Name: 4-[(3-cyanobenzyl)sulfonylamino]butyric acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS(=O)(=O)NCCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CS(=O)(=O)NCCCC(=O)O)C#N

InChI

InChI=1S/C12H14N2O4S/c13-8-10-3-1-4-11(7-10)9-19(17,18)14-6-2-5-12(15)16/h1,3-4,7,14H,2,5-6,9H2,(H,15,16)