(4-azanyl-2-methyl-5-nitro-phenyl) methanesulfonate

Systemtic Name: (4-azanyl-2-methyl-5-nitro-phenyl) methanesulfonate Openeye Name: (4-amino-2-methyl-5-nitro-phenyl) methanesulfonate CAS Name: methanesulfonic acid (4-amino-2-methyl-5-nitrophenyl) ester IUPAC Name: (4-amino-2-methyl-5-nitrophenyl) methanesulfonate Traditional Name: methanesulfonic acid (4-amino-2-methyl-5-nitro-phenyl) ester Formula: C8H10N2O5S MolecularWeight: 246.2404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OS(=O)(=O)C)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC(=C(C=C1OS(=O)(=O)C)[N+](=O)[O-])N

InChI

InChI=1S/C8H10N2O5S/c1-5-3-6(9)7(10(11)12)4-8(5)15-16(2,13)14/h3-4H,9H2,1-2H3