N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[(E)-(3-nitrophenyl)methylideneamino]oxy-ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[(E)-(3-nitrophenyl)methylideneamino]oxy-ethanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-[(E)-(3-nitrophenyl)methyleneamino]oxy-acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-[(E)-(3-nitrophenyl)methylideneamino]oxyacetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-[(E)-(3-nitrophenyl)methylideneamino]oxyacetamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-2-[(E)-(3-nitrobenzylidene)amino]oxy-acetamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CON=CC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CO/N=C/C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24N4O6S/c1-16-8-9-18(13-20(16)32(29,30)24-10-3-2-4-11-24)23-21(26)15-31-22-14-17-6-5-7-19(12-17)25(27)28/h5-9,12-14H,2-4,10-11,15H2,1H3,(H,23,26)/b22-14+