(5-bromanylfuran-2-yl)methyl-[4-(2-chloranyl-3-methyl-6-propan-2-yl-phenoxy)butyl]-dimethyl-azanium

Systemtic Name: (5-bromanylfuran-2-yl)methyl-[4-(2-chloranyl-3-methyl-6-propan-2-yl-phenoxy)butyl]-dimethyl-azanium Openeye Name: (5-bromo-2-furyl)methyl-[4-(2-chloro-6-isopropyl-3-methyl-phenoxy)butyl]-dimethyl-ammonium CAS Name: (5-bromo-2-furanyl)methyl-[4-(2-chloro-3-methyl-6-propan-2-ylphenoxy)butyl]-dimethylammonium IUPAC Name: (5-bromofuran-2-yl)methyl-[4-(2-chloro-3-methyl-6-propan-2-ylphenoxy)butyl]-dimethylazanium Traditional Name: (5-bromo-2-furyl)methyl-[4-(2-chloro-6-isopropyl-3-methyl-phenoxy)butyl]-dimethyl-ammonium Formula: C21H30BrClNO2+ MolecularWeight: 443.8254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)OCCCC[N+](C)(C)CC2=CC=C(O2)Br)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)OCCCC[N+](C)(C)CC2=CC=C(O2)Br)Cl

InChI

InChI=1S/C21H30BrClNO2/c1-15(2)18-10-8-16(3)20(23)21(18)25-13-7-6-12-24(4,5)14-17-9-11-19(22)26-17/h8-11,15H,6-7,12-14H2,1-5H3/q+1