(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(3-methoxypropyl)azanium

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(3-methoxypropyl)azanium Openeye Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)methyl-(3-methoxypropyl)ammonium CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-(3-methoxypropyl)ammonium IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-(3-methoxypropyl)azanium Traditional Name: (3-bromo-4-ethoxy-5-methoxy-benzyl)-(3-methoxypropyl)ammonium Formula: C14H23BrNO3+ MolecularWeight: 333.24132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]CCCOC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]CCCOC)OC

InChI

InChI=1S/C14H22BrNO3/c1-4-19-14-12(15)8-11(9-13(14)18-3)10-16-6-5-7-17-2/h8-9,16H,4-7,10H2,1-3H3/p+1