(2-azanyl-3-nitro-phenyl)methyl methanesulfonate

Systemtic Name: (2-azanyl-3-nitro-phenyl)methyl methanesulfonate Openeye Name: (2-amino-3-nitro-phenyl)methyl methanesulfonate CAS Name: methanesulfonic acid (2-amino-3-nitrophenyl)methyl ester IUPAC Name: (2-amino-3-nitrophenyl)methyl methanesulfonate Traditional Name: methanesulfonic acid (2-amino-3-nitro-benzyl) ester Formula: C8H10N2O5S MolecularWeight: 246.2404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10N2O5S/c1-16(13,14)15-5-6-3-2-4-7(8(6)9)10(11)12/h2-4H,5,9H2,1H3