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

Systemtic Name: [3-bromanyl-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: [3-bromo-5-ethoxy-4-(p-tolylmethoxy)phenyl]methyl-(3-isopropoxypropyl)ammonium CAS Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [3-bromo-5-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: [3-bromo-5-ethoxy-4-(4-methylbenzyl)oxy-benzyl]-(3-isopropoxypropyl)ammonium Formula: C23H33BrNO3+ MolecularWeight: 451.41702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32BrNO3/c1-5-26-22-14-20(15-25-11-6-12-27-17(2)3)13-21(24)23(22)28-16-19-9-7-18(4)8-10-19/h7-10,13-14,17,25H,5-6,11-12,15-16H2,1-4H3/p+1