ethyl 4-(4-methylsulfonylpiperazin-1-ium-1-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(4-methylsulfonylpiperazin-1-ium-1-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(4-methylsulfonylpiperazin-1-ium-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-methylsulfonyl-1-piperazin-1-iumyl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylsulfonylpiperazin-1-ium-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-mesylpiperazin-1-ium-1-yl)piperidine-1-carboxylic acid ethyl ester Formula: C13H26N3O4S+ MolecularWeight: 320.42824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H25N3O4S/c1-3-20-13(17)15-6-4-12(5-7-15)14-8-10-16(11-9-14)21(2,18)19/h12H,3-11H2,1-2H3/p+1