3-hexadecanoyloxypropyl-dimethyl-[2-[[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methoxy]ethyl]azanium iodide

Systemtic Name: 3-hexadecanoyloxypropyl-dimethyl-[2-[[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methoxy]ethyl]azanium iodide Openeye Name: 3-hexadecanoyloxypropyl-dimethyl-[2-[(5-methyl-2,4-dioxo-pyrimidin-1-yl)methoxy]ethyl]ammonium iodide CAS Name: dimethyl-[2-[(5-methyl-2,4-dioxo-1-pyrimidinyl)methoxy]ethyl]-[3-(1-oxohexadecoxy)propyl]ammonium iodide IUPAC Name: 3-hexadecanoyloxypropyl-dimethyl-[2-[(5-methyl-2,4-dioxopyrimidin-1-yl)methoxy]ethyl]azanium iodide Traditional Name: 2-[(2,4-diketo-5-methyl-pyrimidin-1-yl)methoxy]ethyl-(3-hexadecanoyloxypropyl)-dimethyl-ammonium iodide Formula: C29H54IN3O5 MolecularWeight: 651.66063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCC[N+](C)(C)CCOCN1C=C(C(=O)NC1=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCC[N+](C)(C)CCOCN1C=C(C(=O)NC1=O)C.[I-]

InChI

InChI=1S/C29H53N3O5.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-27(33)37-22-18-20-32(3,4)21-23-36-25-31-24-26(2)28(34)30-29(31)35;/h24H,5-23,25H2,1-4H3;1H