(3-bromanyl-4-prop-2-enoxy-phenyl)methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: (3-bromanyl-4-prop-2-enoxy-phenyl)methyl-[(4-methylphenyl)methyl]azanium Openeye Name: (4-allyloxy-3-bromo-phenyl)methyl-(p-tolylmethyl)ammonium CAS Name: (3-bromo-4-prop-2-enoxyphenyl)methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (3-bromo-4-prop-2-enoxyphenyl)methyl-[(4-methylphenyl)methyl]azanium Traditional Name: (4-allyloxy-3-bromo-benzyl)-(4-methylbenzyl)ammonium Formula: C18H21BrNO+ MolecularWeight: 347.26944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)OCC=C)Br

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)OCC=C)Br

InChI

InChI=1S/C18H20BrNO/c1-3-10-21-18-9-8-16(11-17(18)19)13-20-12-15-6-4-14(2)5-7-15/h3-9,11,20H,1,10,12-13H2,2H3/p+1