[5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-(3-ethoxypropyl)azanium

Systemtic Name: [5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-(3-ethoxypropyl)azanium Openeye Name: [5-bromo-2-(p-tolylmethoxy)phenyl]methyl-(3-ethoxypropyl)ammonium CAS Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-(3-ethoxypropyl)ammonium IUPAC Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-(3-ethoxypropyl)azanium Traditional Name: [5-bromo-2-(4-methylbenzyl)oxy-benzyl]-(3-ethoxypropyl)ammonium Formula: C20H27BrNO2+ MolecularWeight: 393.33788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26BrNO2/c1-3-23-12-4-11-22-14-18-13-19(21)9-10-20(18)24-15-17-7-5-16(2)6-8-17/h5-10,13,22H,3-4,11-12,14-15H2,1-2H3/p+1