2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 4-chloranyl-3-nitro-benzoate

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]sulfanylethyl 4-chloranyl-3-nitro-benzoate Openeye Name: 2-(2,5-dichlorophenyl)sulfanylethyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester IUPAC Name: 2-(2,5-dichlorophenyl)sulfanylethyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid 2-[(2,5-dichlorophenyl)thio]ethyl ester Formula: C15H10Cl3NO4S MolecularWeight: 406.6682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OCCSC2=C(C=CC(=C2)Cl)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OCCSC2=C(C=CC(=C2)Cl)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10Cl3NO4S/c16-10-2-4-12(18)14(8-10)24-6-5-23-15(20)9-1-3-11(17)13(7-9)19(21)22/h1-4,7-8H,5-6H2