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

Systemtic Name: hexyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: hexyl-[[2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: hexyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: hexyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: hexyl-[2-(4-methylbenzyl)oxybenzyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1=CC=CC=C1OCC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC[NH2+]CC1=CC=CC=C1OCC2=CC=C(C=C2)C

InChI

InChI=1S/C21H29NO/c1-3-4-5-8-15-22-16-20-9-6-7-10-21(20)23-17-19-13-11-18(2)12-14-19/h6-7,9-14,22H,3-5,8,15-17H2,1-2H3/p+1