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

Systemtic Name: [2-[(2-bromanyl-4-propan-2-yl-phenoxy)methyl]phenyl]methylazanium Openeye Name: [2-[(2-bromo-4-isopropyl-phenoxy)methyl]phenyl]methylammonium CAS Name: [2-[(2-bromo-4-propan-2-ylphenoxy)methyl]phenyl]methylammonium IUPAC Name: [2-[(2-bromo-4-propan-2-ylphenoxy)methyl]phenyl]methylazanium Traditional Name: [2-[(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=CC=C2C[NH3+])Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2C[NH3+])Br

InChI

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