(3-ethoxy-4-prop-2-enoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium

Systemtic Name: (3-ethoxy-4-prop-2-enoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium Openeye Name: (4-allyloxy-3-ethoxy-phenyl)methyl-[3-(methylammonio)propyl]ammonium CAS Name: (3-ethoxy-4-prop-2-enoxyphenyl)methyl-[3-(methylammonio)propyl]ammonium IUPAC Name: (3-ethoxy-4-prop-2-enoxyphenyl)methyl-[3-(methylazaniumyl)propyl]azanium Traditional Name: (4-allyloxy-3-ethoxy-benzyl)-[3-(methylammonio)propyl]ammonium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCC[NH2+]C)OCC=C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCC[NH2+]C)OCC=C

InChI

InChI=1S/C16H26N2O2/c1-4-11-20-15-8-7-14(12-16(15)19-5-2)13-18-10-6-9-17-3/h4,7-8,12,17-18H,1,5-6,9-11,13H2,2-3H3/p+2