2-[(2,5-dimethylphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonylamino]pentanoic acid Openeye Name: 2-[(2,5-dimethylphenyl)sulfonylamino]pentanoic acid CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]pentanoic acid IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonylamino]pentanoic acid Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]valeric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)C)C

Isomeric SMILES

CCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)C)C

InChI

InChI=1S/C13H19NO4S/c1-4-5-11(13(15)16)14-19(17,18)12-8-9(2)6-7-10(12)3/h6-8,11,14H,4-5H2,1-3H3,(H,15,16)