ethyl 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-chloro-4-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-chloro-4-methyl-5-nitro-phenyl)sulfonylisonipecotic acid ethyl ester Formula: C15H19ClN2O6S MolecularWeight: 390.83916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C15H19ClN2O6S/c1-3-24-15(19)11-4-6-17(7-5-11)25(22,23)12-8-13(16)10(2)14(9-12)18(20)21/h8-9,11H,3-7H2,1-2H3