[6-chloranyl-2-[(4-methylphenyl)sulfonyloxymethyl]-5-nitroso-oxan-3-yl] ethanoate

Systemtic Name: [6-chloranyl-2-[(4-methylphenyl)sulfonyloxymethyl]-5-nitroso-oxan-3-yl] ethanoate Openeye Name: [6-chloro-5-nitroso-2-(p-tolylsulfonyloxymethyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [6-chloro-2-[(4-methylphenyl)sulfonyloxymethyl]-5-nitroso-3-oxanyl] ester IUPAC Name: [6-chloro-2-[(4-methylphenyl)sulfonyloxymethyl]-5-nitrosooxan-3-yl] acetate Traditional Name: acetic acid [6-chloro-5-nitroso-2-(tosyloxymethyl)tetrahydropyran-3-yl] ester Formula: C15H18ClNO7S MolecularWeight: 391.82392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(CC(C(O2)Cl)N=O)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(CC(C(O2)Cl)N=O)OC(=O)C

InChI

InChI=1S/C15H18ClNO7S/c1-9-3-5-11(6-4-9)25(20,21)22-8-14-13(23-10(2)18)7-12(17-19)15(16)24-14/h3-6,12-15H,7-8H2,1-2H3