cyclohexyl-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide

Systemtic Name: cyclohexyl-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide Openeye Name: cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]ammonium bromide CAS Name: cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]ammonium bromide IUPAC Name: cyclohexyl-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]azanium bromide Traditional Name: cyclohexyl-[2-keto-2-(3,4,5-trimethoxyphenyl)ethyl]ammonium bromide Formula: C17H26BrNO4 MolecularWeight: 388.29664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C[NH2+]C2CCCCC2.[Br-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C[NH2+]C2CCCCC2.[Br-]

InChI

InChI=1S/C17H25NO4.BrH/c1-20-15-9-12(10-16(21-2)17(15)22-3)14(19)11-18-13-7-5-4-6-8-13;/h9-10,13,18H,4-8,11H2,1-3H3;1H