1-[(3R,4S,5R)-5-methyl-3,4-bis(oxidanyl)oxolan-2-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(3R,4S,5R)-5-methyl-3,4-bis(oxidanyl)oxolan-2-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(3R,4S,5R)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(3R,4S,5R)-3,4-dihydroxy-5-methyl-2-oxolanyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(3R,4S,5R)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]pyridin-1-ium-3-carboxamide Formula: C11H15N2O4+ MolecularWeight: 239.2478

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(O1)[N+]2=CC=CC(=C2)C(=O)N)O)O

Isomeric SMILES

C[C@@H]1[C@H]([C@H](C(O1)[N+]2=CC=CC(=C2)C(=O)N)O)O

InChI

InChI=1S/C11H14N2O4/c1-6-8(14)9(15)11(17-6)13-4-2-3-7(5-13)10(12)16/h2-6,8-9,11,14-15H,1H3,(H-,12,16)/p+1/t6-,8-,9-,11?/m1/s1