3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]propanoate

Systemtic Name: 3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]propanoate Openeye Name: 3-[(4-chloro-3-nitro-phenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chloro-3-nitrophenyl)sulfonylamino]propanoate IUPAC Name: 3-[(4-chloro-3-nitrophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chloro-3-nitro-phenyl)sulfonylamino]propionate Formula: C9H8ClN2O6S- MolecularWeight: 307.68762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCC(=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCC(=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C9H9ClN2O6S/c10-7-2-1-6(5-8(7)12(15)16)19(17,18)11-4-3-9(13)14/h1-2,5,11H,3-4H2,(H,13,14)/p-1