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

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methoxyethyl)azanium Openeye Name: [3-bromo-5-ethoxy-4-(p-tolylmethoxy)phenyl]methyl-(2-methoxyethyl)ammonium CAS Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(2-methoxyethyl)azanium Traditional Name: [3-bromo-5-ethoxy-4-(4-methylbenzyl)oxy-benzyl]-(2-methoxyethyl)ammonium Formula: C20H27BrNO3+ MolecularWeight: 409.33728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCOC)Br)OCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCOC)Br)OCC2=CC=C(C=C2)C

InChI

InChI=1S/C20H26BrNO3/c1-4-24-19-12-17(13-22-9-10-23-3)11-18(21)20(19)25-14-16-7-5-15(2)6-8-16/h5-8,11-12,22H,4,9-10,13-14H2,1-3H3/p+1