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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C[NH3+])C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C[NH3+])C(C)(C)C

InChI

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