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2-[(2,5-dimethylphenyl)sulfonylamino]-3-methyl-butanoic acid

2-[(2,5-dimethylphenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name:2-[(2,5-dimethylphenyl)sulfonylamino]-3-methyl-butanoic acid
Openeye Name:2-[(2,5-dimethylphenyl)sulfonylamino]-3-methyl-butanoic acid
CAS Name:2-[(2,5-dimethylphenyl)sulfonylamino]-3-methylbutanoic acid
IUPAC Name:2-[(2,5-dimethylphenyl)sulfonylamino]-3-methylbutanoic acid
Traditional Name:2-[(2,5-dimethylphenyl)sulfonylamino]-3-methyl-butyric acid
Formula: C13H19NO4S
MolecularWeight: 285.35926
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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