ethyl 1-(4-piperidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-piperidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-(1-piperidylsulfonyl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(1-piperidinylsulfonyl)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-piperidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-piperidinosulfonylphenyl)sulfonylisonipecotic acid ethyl ester Formula: C19H28N2O6S2 MolecularWeight: 444.56542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H28N2O6S2/c1-2-27-19(22)16-10-14-21(15-11-16)29(25,26)18-8-6-17(7-9-18)28(23,24)20-12-4-3-5-13-20/h6-9,16H,2-5,10-15H2,1H3