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

Systemtic Name: (3-nitrophenyl)methyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (3-nitrophenyl)methyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (3-nitrobenzyl) ester Formula: C15H12ClNO6S MolecularWeight: 369.77688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClNO6S/c1-24(21,22)12-5-6-14(16)13(8-12)15(18)23-9-10-3-2-4-11(7-10)17(19)20/h2-8H,9H2,1H3