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

Systemtic Name: 4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]butanoate Openeye Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]butanoate CAS Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]butanoate IUPAC Name: 4-[(4-chloro-3-nitrophenyl)sulfonylamino]butanoate Traditional Name: 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]butyrate Formula: C10H10ClN2O6S- MolecularWeight: 321.7142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClN2O6S/c11-8-4-3-7(6-9(8)13(16)17)20(18,19)12-5-1-2-10(14)15/h3-4,6,12H,1-2,5H2,(H,14,15)/p-1