methyl 6-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]hexanoate

Systemtic Name: methyl 6-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]hexanoate Openeye Name: methyl 6-[(4-chloro-3-nitro-phenyl)sulfonylamino]hexanoate CAS Name: 6-[(4-chloro-3-nitrophenyl)sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-chloro-3-nitrophenyl)sulfonylamino]hexanoate Traditional Name: 6-[(4-chloro-3-nitro-phenyl)sulfonylamino]hexanoic acid methyl ester Formula: C13H17ClN2O6S MolecularWeight: 364.80188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCCCNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H17ClN2O6S/c1-22-13(17)5-3-2-4-8-15-23(20,21)10-6-7-11(14)12(9-10)16(18)19/h6-7,9,15H,2-5,8H2,1H3