[3,4,5-triacetyloxy-6-[3-(ethylcarbamoyl)pyridin-1-ium-1-yl]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[3-(ethylcarbamoyl)pyridin-1-ium-1-yl]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[3-(ethylcarbamoyl)pyridin-1-ium-1-yl]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[3-(ethylcarbamoyl)-1-pyridin-1-iumyl]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-[3-(ethylcarbamoyl)pyridin-1-ium-1-yl]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[3-(ethylcarbamoyl)pyridin-1-ium-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C22H29N2O10+ MolecularWeight: 481.47306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C[N+](=CC=C1)C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCNC(=O)C1=C[N+](=CC=C1)C2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H28N2O10/c1-6-23-21(29)16-8-7-9-24(10-16)22-20(33-15(5)28)19(32-14(4)27)18(31-13(3)26)17(34-22)11-30-12(2)25/h7-10,17-20,22H,6,11H2,1-5H3/p+1