(2R)-2-[(4,5-dimethyl-2-nitro-phenyl)sulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2R)-2-[(4,5-dimethyl-2-nitro-phenyl)sulfonylamino]-3-oxidanyl-propanoate Openeye Name: (2R)-2-[(4,5-dimethyl-2-nitro-phenyl)sulfonylamino]-3-hydroxy-propanoate CAS Name: (2R)-2-[(4,5-dimethyl-2-nitrophenyl)sulfonylamino]-3-hydroxypropanoate IUPAC Name: (2R)-2-[(4,5-dimethyl-2-nitrophenyl)sulfonylamino]-3-hydroxypropanoate Traditional Name: (2R)-2-[(4,5-dimethyl-2-nitro-phenyl)sulfonylamino]-3-hydroxy-propionate Formula: C11H13N2O7S- MolecularWeight: 317.29512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NC(CO)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N[C@H](CO)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O7S/c1-6-3-9(13(17)18)10(4-7(6)2)21(19,20)12-8(5-14)11(15)16/h3-4,8,12,14H,5H2,1-2H3,(H,15,16)/p-1/t8-/m1/s1