[5-bromanyl-2-[(4-tert-butylphenyl)methoxy]phenyl]methylazanium

Systemtic Name: [5-bromanyl-2-[(4-tert-butylphenyl)methoxy]phenyl]methylazanium Openeye Name: [5-bromo-2-[(4-tert-butylphenyl)methoxy]phenyl]methylammonium CAS Name: [5-bromo-2-[(4-tert-butylphenyl)methoxy]phenyl]methylammonium IUPAC Name: [5-bromo-2-[(4-tert-butylphenyl)methoxy]phenyl]methylazanium Traditional Name: [5-bromo-2-(4-tert-butylbenzyl)oxy-benzyl]ammonium Formula: C18H23BrNO+ MolecularWeight: 349.28532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C[NH3+]

InChI

InChI=1S/C18H22BrNO/c1-18(2,3)15-6-4-13(5-7-15)12-21-17-9-8-16(19)10-14(17)11-20/h4-10H,11-12,20H2,1-3H3/p+1