3-(3-cyanopropylsulfonyl)propanoic acid

Systemtic Name: 3-(3-cyanopropylsulfonyl)propanoic acid Openeye Name: 3-(3-cyanopropylsulfonyl)propanoic acid CAS Name: 3-(3-cyanopropylsulfonyl)propanoic acid IUPAC Name: 3-(3-cyanopropylsulfonyl)propanoic acid Traditional Name: 3-(3-cyanopropylsulfonyl)propionic acid Formula: C7H11NO4S MolecularWeight: 205.23154

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Descriptors Computed from Structure

Canonical SMILES:

C(CC#N)CS(=O)(=O)CCC(=O)O

Isomeric SMILES

C(CC#N)CS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C7H11NO4S/c8-4-1-2-5-13(11,12)6-3-7(9)10/h1-3,5-6H2,(H,9,10)