2-[methyl-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]ethanoate

Systemtic Name: 2-[methyl-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)amino]ethanoate Openeye Name: 2-(N-methyl-4-morpholinosulfonyl-2-nitro-anilino)acetate CAS Name: 2-[N-methyl-4-(4-morpholinylsulfonyl)-2-nitroanilino]acetate IUPAC Name: 2-(N-methyl-4-morpholin-4-ylsulfonyl-2-nitroanilino)acetate Traditional Name: 2-(N-methyl-4-morpholinosulfonyl-2-nitro-anilino)acetate Formula: C13H16N3O7S- MolecularWeight: 358.34704

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)[O-])C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)[O-])C1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O7S/c1-14(9-13(17)18)11-3-2-10(8-12(11)16(19)20)24(21,22)15-4-6-23-7-5-15/h2-3,8H,4-7,9H2,1H3,(H,17,18)/p-1