3-methyl-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-(p-tolylsulfonylamino)acetyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-(tosylamino)acetyl]amino]butyric acid Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C14H20N2O5S/c1-9(2)13(14(18)19)16-12(17)8-15-22(20,21)11-6-4-10(3)5-7-11/h4-7,9,13,15H,8H2,1-3H3,(H,16,17)(H,18,19)