3-[(4-butan-2-ylphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(4-butan-2-ylphenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(4-sec-butylphenyl)sulfonylamino]propanoic acid CAS Name: 3-[(4-butan-2-ylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(4-butan-2-ylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(4-sec-butylphenyl)sulfonylamino]propionic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C13H19NO4S/c1-3-10(2)11-4-6-12(7-5-11)19(17,18)14-9-8-13(15)16/h4-7,10,14H,3,8-9H2,1-2H3,(H,15,16)