[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(phenylmethyl)azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: [3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: benzyl-[3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C23H25BrNO2+ MolecularWeight: 427.3541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]CC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C[NH2+]CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H24BrNO2/c1-17-8-10-19(11-9-17)16-27-23-21(24)12-20(13-22(23)26-2)15-25-14-18-6-4-3-5-7-18/h3-13,25H,14-16H2,1-2H3/p+1