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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCOC1=C(C=C(C=C1)C(C)C)Br

Isomeric SMILES

CC[NH2+]CCOC1=C(C=C(C=C1)C(C)C)Br

InChI

InChI=1S/C13H20BrNO/c1-4-15-7-8-16-13-6-5-11(10(2)3)9-12(13)14/h5-6,9-10,15H,4,7-8H2,1-3H3/p+1