[3-nitro-5-(oxan-2-yloxymethyl)phenyl]methyl methanesulfonate

Systemtic Name: [3-nitro-5-(oxan-2-yloxymethyl)phenyl]methyl methanesulfonate Openeye Name: [3-nitro-5-(tetrahydropyran-2-yloxymethyl)phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-nitro-5-(2-oxanyloxymethyl)phenyl]methyl ester IUPAC Name: [3-nitro-5-(oxan-2-yloxymethyl)phenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-nitro-5-(tetrahydropyran-2-yloxymethyl)benzyl] ester Formula: C14H19NO7S MolecularWeight: 345.36816

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=CC(=CC(=C1)COC2CCCCO2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OCC1=CC(=CC(=C1)COC2CCCCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H19NO7S/c1-23(18,19)22-10-12-6-11(7-13(8-12)15(16)17)9-21-14-4-2-3-5-20-14/h6-8,14H,2-5,9-10H2,1H3