4-[(4-propan-2-ylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(4-propan-2-ylphenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(4-isopropylphenyl)sulfonylamino]butanoic acid CAS Name: 4-[(4-propan-2-ylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(4-propan-2-ylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-(p-cumenylsulfonylamino)butyric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)O

InChI

InChI=1S/C13H19NO4S/c1-10(2)11-5-7-12(8-6-11)19(17,18)14-9-3-4-13(15)16/h5-8,10,14H,3-4,9H2,1-2H3,(H,15,16)