2-[(3,5-dimethyl-2H-1,2-oxazol-3-yl)sulfonylamino]butanedioic acid

Systemtic Name: 2-[(3,5-dimethyl-2H-1,2-oxazol-3-yl)sulfonylamino]butanedioic acid Openeye Name: 2-[(3,5-dimethyl-2H-isoxazol-3-yl)sulfonylamino]butanedioic acid CAS Name: 2-[(3,5-dimethyl-2H-isoxazol-3-yl)sulfonylamino]butanedioic acid IUPAC Name: 2-[(3,5-dimethyl-2H-1,2-oxazol-3-yl)sulfonylamino]butanedioic acid Traditional Name: 2-[(3,5-dimethyl-4-isoxazolin-3-yl)sulfonylamino]succinic acid Formula: C9H14N2O7S MolecularWeight: 294.28166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NO1)(C)S(=O)(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(NO1)(C)S(=O)(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C9H14N2O7S/c1-5-4-9(2,11-18-5)19(16,17)10-6(8(14)15)3-7(12)13/h4,6,10-11H,3H2,1-2H3,(H,12,13)(H,14,15)