3-[(4-methoxyphenyl)sulfonyl-[3-methylbutanoyl(oxidanyl)amino]amino]propanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)sulfonyl-[3-methylbutanoyl(oxidanyl)amino]amino]propanoic acid Openeye Name: 3-[[hydroxy(3-methylbutanoyl)amino]-(4-methoxyphenyl)sulfonyl-amino]propanoic acid CAS Name: 3-[[hydroxy-(3-methyl-1-oxobutyl)amino]-(4-methoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[[hydroxy(3-methylbutanoyl)amino]-(4-methoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[[hydroxy(isovaleryl)amino]-(4-methoxyphenyl)sulfonyl-amino]propionic acid Formula: C15H22N2O7S MolecularWeight: 374.40938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(N(CCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC)O

Isomeric SMILES

CC(C)CC(=O)N(N(CCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC)O

InChI

InChI=1S/C15H22N2O7S/c1-11(2)10-14(18)17(21)16(9-8-15(19)20)25(22,23)13-6-4-12(24-3)5-7-13/h4-7,11,21H,8-10H2,1-3H3,(H,19,20)