(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (4-allyloxy-3-bromo-5-methoxy-phenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C16H23BrNO3+ MolecularWeight: 357.26272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC2CCCO2)Br)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C[C@H]2CCCO2)Br)OCC=C

InChI

InChI=1S/C16H22BrNO3/c1-3-6-21-16-14(17)8-12(9-15(16)19-2)10-18-11-13-5-4-7-20-13/h3,8-9,13,18H,1,4-7,10-11H2,2H3/p+1/t13-/m1/s1