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4-[2-cyanoethyl(pyridin-3-ylmethyl)sulfamoyl]butanoate

4-[2-cyanoethyl(pyridin-3-ylmethyl)sulfamoyl]butanoate

Systemtic Name:4-[2-cyanoethyl(pyridin-3-ylmethyl)sulfamoyl]butanoate
Openeye Name:4-[2-cyanoethyl(3-pyridylmethyl)sulfamoyl]butanoate
CAS Name:4-[2-cyanoethyl(3-pyridinylmethyl)sulfamoyl]butanoate
IUPAC Name:4-[2-cyanoethyl(pyridin-3-ylmethyl)sulfamoyl]butanoate
Traditional Name:4-[2-cyanoethyl(3-pyridylmethyl)sulfamoyl]butyrate
Formula: C13H16N3O4S-
MolecularWeight: 310.34884
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC#N)S(=O)(=O)CCCC(=O)[O-]


Isomeric SMILES

C1=CC(=CN=C1)CN(CCC#N)S(=O)(=O)CCCC(=O)[O-]


InChI

InChI=1S/C13H17N3O4S/c14-6-3-8-16(11-12-4-1-7-15-10-12)21(19,20)9-2-5-13(17)18/h1,4,7,10H,2-3,5,8-9,11H2,(H,17,18)/p-1


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