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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])C(=O)OCCSC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])C(=O)OCCSC2=C(C=CC(=C2)Cl)Cl

InChI

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