2-(4-chlorophenyl)sulfanylethyl 2-chloranyl-4-nitro-benzoate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 2-chloranyl-4-nitro-benzoate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C15H11Cl2NO4S MolecularWeight: 372.22314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCOC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1SCCOC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C15H11Cl2NO4S/c16-10-1-4-12(5-2-10)23-8-7-22-15(19)13-6-3-11(18(20)21)9-14(13)17/h1-6,9H,7-8H2