[4-[(2-bromanyl-4-propan-2-yl-phenoxy)methyl]phenyl]methylazanium

Systemtic Name: [4-[(2-bromanyl-4-propan-2-yl-phenoxy)methyl]phenyl]methylazanium Openeye Name: [4-[(2-bromo-4-isopropyl-phenoxy)methyl]phenyl]methylammonium CAS Name: [4-[(2-bromo-4-propan-2-ylphenoxy)methyl]phenyl]methylammonium IUPAC Name: [4-[(2-bromo-4-propan-2-ylphenoxy)methyl]phenyl]methylazanium Traditional Name: [4-[(2-bromo-4-isopropyl-phenoxy)methyl]benzyl]ammonium Formula: C17H21BrNO+ MolecularWeight: 335.25874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C[NH3+])Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C[NH3+])Br

InChI

InChI=1S/C17H20BrNO/c1-12(2)15-7-8-17(16(18)9-15)20-11-14-5-3-13(10-19)4-6-14/h3-9,12H,10-11,19H2,1-2H3/p+1