2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: 2-[(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]acetate IUPAC Name: 2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[(3-chloro-4-methyl-5-nitro-phenyl)sulfonylamino]acetate Formula: C9H8ClN2O6S- MolecularWeight: 307.68762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCC(=O)[O-])Cl

InChI

InChI=1S/C9H9ClN2O6S/c1-5-7(10)2-6(3-8(5)12(15)16)19(17,18)11-4-9(13)14/h2-3,11H,4H2,1H3,(H,13,14)/p-1