3-[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]propanoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]propanoic acid Openeye Name: 3-[(4-tert-butylphenyl)methyl-methylsulfonyl-amino]propanoic acid CAS Name: 3-[(4-tert-butylphenyl)methyl-methylsulfonylamino]propanoic acid IUPAC Name: 3-[(4-tert-butylphenyl)methyl-methylsulfonylamino]propanoic acid Traditional Name: 3-[(4-tert-butylbenzyl)-mesyl-amino]propionic acid Formula: C15H23NO4S MolecularWeight: 313.41242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO4S/c1-15(2,3)13-7-5-12(6-8-13)11-16(21(4,19)20)10-9-14(17)18/h5-8H,9-11H2,1-4H3,(H,17,18)