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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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