2-(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethyl-azanium bromide

Systemtic Name: 2-(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethyl-azanium bromide Openeye Name: 2-(6-acetoxy-2,5,7,8-tetramethyl-chroman-2-yl)ethyl-trimethyl-ammonium bromide CAS Name: 2-(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl)ethyl-trimethylammonium bromide IUPAC Name: 2-(6-acetyloxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethylazanium bromide Traditional Name: 2-(6-acetoxy-2,5,7,8-tetramethyl-chroman-2-yl)ethyl-trimethyl-ammonium bromide Formula: C20H32BrNO3 MolecularWeight: 414.37698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)CC[N+](C)(C)C.[Br-]

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)CC[N+](C)(C)C.[Br-]

InChI

InChI=1S/C20H32NO3.BrH/c1-13-14(2)19-17(15(3)18(13)23-16(4)22)9-10-20(5,24-19)11-12-21(6,7)8;/h9-12H2,1-8H3;1H/q+1;/p-1