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

Systemtic Name: [4-[(2-bromanyl-6-tert-butyl-4-methoxy-phenoxy)methyl]phenyl]methylazanium Openeye Name: [4-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]phenyl]methylammonium CAS Name: [4-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]phenyl]methylammonium IUPAC Name: [4-[(2-bromo-6-tert-butyl-4-methoxyphenoxy)methyl]phenyl]methylazanium Traditional Name: [4-[(2-bromo-6-tert-butyl-4-methoxy-phenoxy)methyl]benzyl]ammonium Formula: C19H25BrNO2+ MolecularWeight: 379.3113

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(C=C2)C[NH3+])Br)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OCC2=CC=C(C=C2)C[NH3+])Br)OC

InChI

InChI=1S/C19H24BrNO2/c1-19(2,3)16-9-15(22-4)10-17(20)18(16)23-12-14-7-5-13(11-21)6-8-14/h5-10H,11-12,21H2,1-4H3/p+1