1-[(2R,5S)-4-azido-5-[2-(1-methylpyridin-1-ium-3-yl)-1-oxidanyl-2-oxidanylidene-ethyl]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,5S)-4-azido-5-[2-(1-methylpyridin-1-ium-3-yl)-1-oxidanyl-2-oxidanylidene-ethyl]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,5S)-4-azido-5-[1-hydroxy-2-(1-methylpyridin-1-ium-3-yl)-2-oxo-ethyl]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,5S)-4-azido-5-[1-hydroxy-2-(1-methyl-3-pyridin-1-iumyl)-2-oxoethyl]-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,5S)-4-azido-5-[1-hydroxy-2-(1-methylpyridin-1-ium-3-yl)-2-oxoethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,5S)-4-azido-5-[1-hydroxy-2-keto-2-(1-methylpyridin-1-ium-3-yl)ethyl]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C17H19N6O5+ MolecularWeight: 387.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)C(C(=O)C3=C[N+](=CC=C3)C)O)N=[N+]=[N-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2CC([C@H](O2)C(C(=O)C3=C[N+](=CC=C3)C)O)N=[N+]=[N-]

InChI

InChI=1S/C17H18N6O5/c1-9-7-23(17(27)19-16(9)26)12-6-11(20-21-18)15(28-12)14(25)13(24)10-4-3-5-22(2)8-10/h3-5,7-8,11-12,14-15,25H,6H2,1-2H3/p+1/t11?,12-,14?,15+/m1/s1