4-[(2,4,5-trimethylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(2,4,5-trimethylphenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(2,4,5-trimethylphenyl)sulfonylamino]butanoic acid CAS Name: 4-[(2,4,5-trimethylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(2,4,5-trimethylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(2,4,5-trimethylphenyl)sulfonylamino]butyric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NCCCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NCCCC(=O)O)C

InChI

InChI=1S/C13H19NO4S/c1-9-7-11(3)12(8-10(9)2)19(17,18)14-6-4-5-13(15)16/h7-8,14H,4-6H2,1-3H3,(H,15,16)