hexyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: hexyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: hexyl-[[3-methoxy-2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: hexyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: hexyl-[[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: hexyl-[3-methoxy-2-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C22H32NO2+ MolecularWeight: 342.49498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=C(C=C2)C

InChI

InChI=1S/C22H31NO2/c1-4-5-6-7-15-23-16-20-9-8-10-21(24-3)22(20)25-17-19-13-11-18(2)12-14-19/h8-14,23H,4-7,15-17H2,1-3H3/p+1