(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(furan-2-ylmethyl)azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(furan-2-ylmethyl)azanium Openeye Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)methyl-(2-furylmethyl)ammonium CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-(2-furanylmethyl)ammonium IUPAC Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-(furan-2-ylmethyl)azanium Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-(2-furfuryl)ammonium Formula: C15H19BrNO3+ MolecularWeight: 341.22026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC2=CC=CO2)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CC2=CC=CO2)Br)OC

InChI

InChI=1S/C15H18BrNO3/c1-3-19-14-8-11(7-13(16)15(14)18-2)9-17-10-12-5-4-6-20-12/h4-8,17H,3,9-10H2,1-2H3/p+1