[2-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]methylazanium

Systemtic Name: [2-[(4-bromanyl-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]methylazanium Openeye Name: [2-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]phenyl]methylammonium CAS Name: [2-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]phenyl]methylammonium IUPAC Name: [2-[(4-bromo-2-tert-butyl-6-methylphenoxy)methyl]phenyl]methylazanium Traditional Name: [2-[(4-bromo-2-tert-butyl-6-methyl-phenoxy)methyl]benzyl]ammonium Formula: C19H25BrNO+ MolecularWeight: 363.3119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=CC=C2C[NH3+])C(C)(C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=CC=C2C[NH3+])C(C)(C)C)Br

InChI

InChI=1S/C19H24BrNO/c1-13-9-16(20)10-17(19(2,3)4)18(13)22-12-15-8-6-5-7-14(15)11-21/h5-10H,11-12,21H2,1-4H3/p+1