ethyl 4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazine-1-carboxylate CAS Name: 4-[5-(4-morpholinylsulfonyl)-2-pyridin-1-iumyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-morpholin-4-ylsulfonylpyridin-1-ium-2-yl)piperazine-1-carboxylate Traditional Name: 4-(5-morpholinosulfonylpyridin-1-ium-2-yl)piperazine-1-carboxylic acid ethyl ester Formula: C16H25N4O5S+ MolecularWeight: 385.4585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H24N4O5S/c1-2-25-16(21)19-7-5-18(6-8-19)15-4-3-14(13-17-15)26(22,23)20-9-11-24-12-10-20/h3-4,13H,2,5-12H2,1H3/p+1