1-[3-(oxan-2-yloxymethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone

Systemtic Name: 1-[3-(oxan-2-yloxymethyl)-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl]ethanone Openeye Name: 1-[4-oxido-1-oxo-3-(tetrahydropyran-2-yloxymethyl)quinoxalin-1-ium-2-yl]ethanone CAS Name: 1-[3-(2-oxanyloxymethyl)-4-oxido-1-oxo-2-quinoxalin-1-iumyl]ethanone IUPAC Name: 1-[3-(oxan-2-yloxymethyl)-4-oxido-1-oxoquinoxalin-1-ium-2-yl]ethanone Traditional Name: 1-[1-keto-4-oxido-3-(tetrahydropyran-2-yloxymethyl)quinoxalin-1-ium-2-yl]ethanone Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])COC3CCCCO3

Isomeric SMILES

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])COC3CCCCO3

InChI

InChI=1S/C16H18N2O5/c1-11(19)16-14(10-23-15-8-4-5-9-22-15)17(20)12-6-2-3-7-13(12)18(16)21/h2-3,6-7,15H,4-5,8-10H2,1H3