cyclohexyl 2-[(S)-(4-methylsulfonyl-2-nitro-phenyl)sulfinyl]ethanoate

Systemtic Name: cyclohexyl 2-[(S)-(4-methylsulfonyl-2-nitro-phenyl)sulfinyl]ethanoate Openeye Name: cyclohexyl 2-[(S)-(4-methylsulfonyl-2-nitro-phenyl)sulfinyl]acetate CAS Name: 2-[(S)-(4-methylsulfonyl-2-nitrophenyl)sulfinyl]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[(S)-(4-methylsulfonyl-2-nitrophenyl)sulfinyl]acetate Traditional Name: 2-[(S)-(4-mesyl-2-nitro-phenyl)sulfinyl]acetic acid cyclohexyl ester Formula: C15H19NO7S2 MolecularWeight: 389.44386

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)S(=O)CC(=O)OC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)[S@@](=O)CC(=O)OC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H19NO7S2/c1-25(21,22)12-7-8-14(13(9-12)16(18)19)24(20)10-15(17)23-11-5-3-2-4-6-11/h7-9,11H,2-6,10H2,1H3/t24-/m0/s1