(3-nitrophenyl)methyl 2-chloranyl-5-methylsulfanyl-benzoate

Systemtic Name: (3-nitrophenyl)methyl 2-chloranyl-5-methylsulfanyl-benzoate Openeye Name: (3-nitrophenyl)methyl 2-chloro-5-methylsulfanyl-benzoate CAS Name: 2-chloro-5-(methylthio)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-chloro-5-methylsulfanylbenzoate Traditional Name: 2-chloro-5-(methylthio)benzoic acid (3-nitrobenzyl) ester Formula: C15H12ClNO4S MolecularWeight: 337.77808

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO4S/c1-22-12-5-6-14(16)13(8-12)15(18)21-9-10-3-2-4-11(7-10)17(19)20/h2-8H,9H2,1H3