[5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-pentyl-azanium

Systemtic Name: [5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-pentyl-azanium Openeye Name: [5-bromo-2-(p-tolylmethoxy)phenyl]methyl-pentyl-ammonium CAS Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-pentylammonium IUPAC Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-pentylazanium Traditional Name: amyl-[5-bromo-2-(4-methylbenzyl)oxy-benzyl]ammonium Formula: C20H27BrNO+ MolecularWeight: 377.33848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26BrNO/c1-3-4-5-12-22-14-18-13-19(21)10-11-20(18)23-15-17-8-6-16(2)7-9-17/h6-11,13,22H,3-5,12,14-15H2,1-2H3/p+1