2-(3-chloranylphenoxy)ethyl 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: 2-(3-chloranylphenoxy)ethyl 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: 2-(3-chlorophenoxy)ethyl 2-[(4-methylsulfanyl-3-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[[4-(methylthio)-3-nitrophenyl]sulfonylamino]acetic acid 2-(3-chlorophenoxy)ethyl ester IUPAC Name: 2-(3-chlorophenoxy)ethyl 2-[(4-methylsulfanyl-3-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[[4-(methylthio)-3-nitro-phenyl]sulfonylamino]acetic acid 2-(3-chlorophenoxy)ethyl ester Formula: C17H17ClN2O7S2 MolecularWeight: 460.90908

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCCOC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O7S2/c1-28-16-6-5-14(10-15(16)20(22)23)29(24,25)19-11-17(21)27-8-7-26-13-4-2-3-12(18)9-13/h2-6,9-10,19H,7-8,11H2,1H3