7-[(2-cyanophenyl)sulfonylamino]heptanoic acid

Systemtic Name: 7-[(2-cyanophenyl)sulfonylamino]heptanoic acid Openeye Name: 7-[(2-cyanophenyl)sulfonylamino]heptanoic acid CAS Name: 7-[(2-cyanophenyl)sulfonylamino]heptanoic acid IUPAC Name: 7-[(2-cyanophenyl)sulfonylamino]heptanoic acid Traditional Name: 7-[(2-cyanophenyl)sulfonylamino]enanthic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)S(=O)(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)S(=O)(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C14H18N2O4S/c15-11-12-7-4-5-8-13(12)21(19,20)16-10-6-2-1-3-9-14(17)18/h4-5,7-8,16H,1-3,6,9-10H2,(H,17,18)