ethyl 1-[2-[2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoyloxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoyloxy]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[2-(4-carbamoyl-2-nitro-phenyl)sulfanylacetyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[2-[(4-carbamoyl-2-nitrophenyl)thio]-1-oxoethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(4-carbamoyl-2-nitrophenyl)sulfanylacetyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[2-[(4-carbamoyl-2-nitro-phenyl)thio]acetyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C19H23N3O8S MolecularWeight: 453.46622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O8S/c1-2-29-19(26)12-5-7-21(8-6-12)16(23)10-30-17(24)11-31-15-4-3-13(18(20)25)9-14(15)22(27)28/h3-4,9,12H,2,5-8,10-11H2,1H3,(H2,20,25)