[(3Z)-1-chloranyl-4-oxidanylidene-3-(1H-pyridin-2-ylidene)quinolizin-5-ium-2-yl] trideuteriomethyl carbonate

Systemtic Name: [(3Z)-1-chloranyl-4-oxidanylidene-3-(1H-pyridin-2-ylidene)quinolizin-5-ium-2-yl] trideuteriomethyl carbonate Openeye Name: [(3Z)-1-chloro-4-oxo-3-(1H-pyridin-2-ylidene)quinolizin-5-ium-2-yl] trideuteriomethyl carbonate CAS Name: carbonic acid [(3Z)-1-chloro-4-oxo-3-(1H-pyridin-2-ylidene)-2-quinolizin-5-iumyl] trideuteriomethyl ester IUPAC Name: [(3Z)-1-chloro-4-oxo-3-(1H-pyridin-2-ylidene)quinolizin-5-ium-2-yl] trideuteriomethyl carbonate Traditional Name: carbonic acid [(3Z)-1-chloro-4-keto-3-(1H-pyridin-2-ylidene)quinolizin-5-ium-2-yl] trideuteriomethyl ester Formula: C16H12ClN2O4+ MolecularWeight: 334.748965

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=C(C2=CC=CC=[N+]2C(=O)C1=C3C=CC=CN3)Cl

Isomeric SMILES

[2H]C([2H])([2H])OC(=O)OC\1=C(C2=CC=CC=[N+]2C(=O)/C1=C\3/C=CC=CN3)Cl

InChI

InChI=1S/C16H11ClN2O4/c1-22-16(21)23-14-12(10-6-2-4-8-18-10)15(20)19-9-5-3-7-11(19)13(14)17/h2-9H,1H3/p+1/i1D3