methyl 2-[(2-methoxysulfonyl-4,6-dinitro-phenyl)carbonylamino]ethanoate

Systemtic Name: methyl 2-[(2-methoxysulfonyl-4,6-dinitro-phenyl)carbonylamino]ethanoate Openeye Name: methyl 2-[(2-methoxysulfonyl-4,6-dinitro-benzoyl)amino]acetate CAS Name: 2-[[(2-methoxysulfonyl-4,6-dinitrophenyl)-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-methoxysulfonyl-4,6-dinitrobenzoyl)amino]acetate Traditional Name: 2-[(2-methoxysulfonyl-4,6-dinitro-benzoyl)amino]acetic acid methyl ester Formula: C11H11N3O10S MolecularWeight: 377.28414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=C(C=C(C=C1S(=O)(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC(=O)C1=C(C=C(C=C1S(=O)(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O10S/c1-23-9(15)5-12-11(16)10-7(14(19)20)3-6(13(17)18)4-8(10)25(21,22)24-2/h3-4H,5H2,1-2H3,(H,12,16)