ethyl 1-(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(2-morpholinosulfonyl-4-nitro-phenyl)piperidine-4-carboxylate CAS Name: 1-[2-(4-morpholinylsulfonyl)-4-nitrophenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-morpholin-4-ylsulfonyl-4-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-morpholinosulfonyl-4-nitro-phenyl)isonipecotic acid ethyl ester Formula: C18H25N3O7S MolecularWeight: 427.472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H25N3O7S/c1-2-28-18(22)14-5-7-19(8-6-14)16-4-3-15(21(23)24)13-17(16)29(25,26)20-9-11-27-12-10-20/h3-4,13-14H,2,5-12H2,1H3