ANQ9040

cas: 142021-80-5 — see every product listed under this CAS number, including other names

ANQ9040 (CAS 142021-80-5) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas142021-80-5
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Structural formula: {0} (CAS {1})

[(4aS,4bR,6aS,8R,10aS,10bS,12aS)-8-(azepan-1-ylmethyl)-1,1,10a,12a-tetramethyl-2,3,4,4a,4b,5,6,6a,7,9,10,10b,11,12-tetradecahydronaphtho[2,1-f]quinolin-1-ium-8-yl] acetate;benzenesulfonate (CAS 142021-80-5) is a chemical compound with the molecular formula C36H58N2O5S and a molecular weight of 630.9 g/mol. IUPAC name: [(4aS,4bR,6aS,8R,10aS,10bS,12aS)-8-(azepan-1-ylmethyl)-1,1,10a,12a-tetramethyl-2,3,4,4a,4b,5,6,6a,7,9,10,10b,11,12-tetradecahydronaphtho[2,1-f]quinolin-1-ium-8-yl] acetate;benzenesulfonate. InChIKey: MUVZCNJMKMCHMD-IBSDALFFSA-M.

Identity
Molecular formulaC36H58N2O5S
Molecular weight630.9 g/mol
IUPAC name[(4aS,4bR,6aS,8R,10aS,10bS,12aS)-8-(azepan-1-ylmethyl)-1,1,10a,12a-tetramethyl-2,3,4,4a,4b,5,6,6a,7,9,10,10b,11,12-tetradecahydronaphtho[2,1-f]quinolin-1-ium-8-yl] acetate;benzenesulfonate
InChIKeyMUVZCNJMKMCHMD-IBSDALFFSA-M
SMILESCC(=O)O[C@@]1(CC[C@]2([C@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC[N+]4(C)C)C)C)CN5CCCCCC5.C1=CC=C(C=C1)S(=O)(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: orb1698385

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