2-[(3-aminocarbonyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(3-aminocarbonyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(3-carbamoyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[(3-carbamoyl-4-methylphenyl)sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[(3-carbamoyl-4-methylphenyl)sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[(3-carbamoyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butyric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5S/c1-7(2)11(13(17)18)15-21(19,20)9-5-4-8(3)10(6-9)12(14)16/h4-7,11,15H,1-3H3,(H2,14,16)(H,17,18)