3-azanyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-azanyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid Openeye Name: 3-amino-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid CAS Name: 3-amino-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-amino-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-amino-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(CN)C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(CN)C(=O)O)C)C

InChI

InChI=1S/C13H20N2O4S/c1-7-5-8(2)10(4)12(9(7)3)20(18,19)15-11(6-14)13(16)17/h5,11,15H,6,14H2,1-4H3,(H,16,17)