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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO/c1-3-4-5-6-15-22-16-19-11-13-21(14-12-19)23-17-20-9-7-18(2)8-10-20/h7-14,22H,3-6,15-17H2,1-2H3/p+1