2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethyl-methyl-azanium

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethyl-methyl-azanium Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)ethyl-methyl-ammonium CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)ethyl-methylammonium IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)ethyl-methylazanium Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)ethyl-methyl-ammonium Formula: C13H21BrNO+ MolecularWeight: 287.21594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC[NH2+]C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC[NH2+]C

InChI

InChI=1S/C13H20BrNO/c1-9(2)11-8-12(14)10(3)7-13(11)16-6-5-15-4/h7-9,15H,5-6H2,1-4H3/p+1