7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]heptanoic acid

Systemtic Name: 7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]heptanoic acid Openeye Name: 7-[(2,5-dimethyl-3-thienyl)sulfonylamino]heptanoic acid CAS Name: 7-[(2,5-dimethyl-3-thiophenyl)sulfonylamino]heptanoic acid IUPAC Name: 7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]heptanoic acid Traditional Name: 7-[(2,5-dimethyl-3-thienyl)sulfonylamino]enanthic acid Formula: C13H21NO4S2 MolecularWeight: 319.44014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)NCCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C13H21NO4S2/c1-10-9-12(11(2)19-10)20(17,18)14-8-6-4-3-5-7-13(15)16/h9,14H,3-8H2,1-2H3,(H,15,16)