methyl 6-[(2,5-dimethylthiophen-3-yl)sulfonylamino]hexanoate

Systemtic Name: methyl 6-[(2,5-dimethylthiophen-3-yl)sulfonylamino]hexanoate Openeye Name: methyl 6-[(2,5-dimethyl-3-thienyl)sulfonylamino]hexanoate CAS Name: 6-[(2,5-dimethyl-3-thiophenyl)sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2,5-dimethylthiophen-3-yl)sulfonylamino]hexanoate Traditional Name: 6-[(2,5-dimethyl-3-thienyl)sulfonylamino]hexanoic acid methyl ester Formula: C13H21NO4S2 MolecularWeight: 319.44014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)NCCCCCC(=O)OC

InChI

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