4-[(E)-2-phenylethenyl]benzoate; triethyl(2-hydroxyethyl)azanium; hydroiodide

Systemtic Name: 4-[(E)-2-phenylethenyl]benzoate; triethyl(2-hydroxyethyl)azanium; hydroiodide Openeye Name: 4-[(E)-styryl]benzoate; triethyl(2-hydroxyethyl)ammonium; hydroiodide CAS Name: 4-[(E)-2-phenylethenyl]benzoate; triethyl(2-hydroxyethyl)ammonium; hydroiodide IUPAC Name: 4-[(E)-2-phenylethenyl]benzoate; triethyl(2-hydroxyethyl)azanium; hydroiodide Traditional Name: 4-[(E)-styryl]benzoate; triethyl(2-hydroxyethyl)ammonium; hydroiodide Formula: C23H32INO3 MolecularWeight: 497.40955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCO.C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(=O)[O-].I

Isomeric SMILES

CC[N+](CC)(CC)CCO.C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(=O)[O-].I

InChI

InChI=1S/C15H12O2.C8H20NO.HI/c16-15(17)14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12;1-4-9(5-2,6-3)7-8-10;/h1-11H,(H,16,17);10H,4-8H2,1-3H3;1H/q;+1;/p-1/b7-6+;;