6-[(5-chloranyl-2-methoxy-4-nitro-phenyl)sulfonylamino]hexanoic acid

Systemtic Name: 6-[(5-chloranyl-2-methoxy-4-nitro-phenyl)sulfonylamino]hexanoic acid Openeye Name: 6-[(5-chloro-2-methoxy-4-nitro-phenyl)sulfonylamino]hexanoic acid CAS Name: 6-[(5-chloro-2-methoxy-4-nitrophenyl)sulfonylamino]hexanoic acid IUPAC Name: 6-[(5-chloro-2-methoxy-4-nitrophenyl)sulfonylamino]hexanoic acid Traditional Name: 6-[(5-chloro-2-methoxy-4-nitro-phenyl)sulfonylamino]hexanoic acid Formula: C13H17ClN2O7S MolecularWeight: 380.80128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)[N+](=O)[O-])Cl)S(=O)(=O)NCCCCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)[N+](=O)[O-])Cl)S(=O)(=O)NCCCCCC(=O)O

InChI

InChI=1S/C13H17ClN2O7S/c1-23-11-8-10(16(19)20)9(14)7-12(11)24(21,22)15-6-4-2-3-5-13(17)18/h7-8,15H,2-6H2,1H3,(H,17,18)