2-[2,6-bis(chloranyl)phenoxy]ethyl 4-methylsulfanyl-3-nitro-benzoate

Systemtic Name: 2-[2,6-bis(chloranyl)phenoxy]ethyl 4-methylsulfanyl-3-nitro-benzoate Openeye Name: 2-(2,6-dichlorophenoxy)ethyl 4-methylsulfanyl-3-nitro-benzoate CAS Name: 4-(methylthio)-3-nitrobenzoic acid 2-(2,6-dichlorophenoxy)ethyl ester IUPAC Name: 2-(2,6-dichlorophenoxy)ethyl 4-methylsulfanyl-3-nitrobenzoate Traditional Name: 4-(methylthio)-3-nitro-benzoic acid 2-(2,6-dichlorophenoxy)ethyl ester Formula: C16H13Cl2NO5S MolecularWeight: 402.24912

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)OCCOC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)OCCOC2=C(C=CC=C2Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13Cl2NO5S/c1-25-14-6-5-10(9-13(14)19(21)22)16(20)24-8-7-23-15-11(17)3-2-4-12(15)18/h2-6,9H,7-8H2,1H3