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

Systemtic Name: hexyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: hexyl-[[3-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: hexyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: hexyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: hexyl-[3-(4-methylbenzyl)oxybenzyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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