[1-[8-[4-(4-acetyloxyphenyl)carbonyloxyphenoxy]octoxy]-1-oxidanylidene-3-phenyl-propan-2-yl]-trimethyl-azanium

Systemtic Name: [1-[8-[4-(4-acetyloxyphenyl)carbonyloxyphenoxy]octoxy]-1-oxidanylidene-3-phenyl-propan-2-yl]-trimethyl-azanium Openeye Name: [2-[8-[4-(4-acetoxybenzoyl)oxyphenoxy]octoxy]-1-benzyl-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [1-[8-[4-[(4-acetyloxyphenyl)-oxomethoxy]phenoxy]octoxy]-1-oxo-3-phenylpropan-2-yl]-trimethylammonium IUPAC Name: [1-[8-[4-(4-acetyloxybenzoyl)oxyphenoxy]octoxy]-1-oxo-3-phenylpropan-2-yl]-trimethylazanium Traditional Name: [2-[8-[4-(4-acetoxybenzoyl)oxyphenoxy]octoxy]-1-benzyl-2-keto-ethyl]-trimethyl-ammonium Formula: C35H44NO7+ MolecularWeight: 590.72636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCCCCCCOC(=O)C(CC3=CC=CC=C3)[N+](C)(C)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCCCCCCOC(=O)C(CC3=CC=CC=C3)[N+](C)(C)C

InChI

InChI=1S/C35H44NO7/c1-27(37)42-31-18-16-29(17-19-31)34(38)43-32-22-20-30(21-23-32)40-24-12-7-5-6-8-13-25-41-35(39)33(36(2,3)4)26-28-14-10-9-11-15-28/h9-11,14-23,33H,5-8,12-13,24-26H2,1-4H3/q+1