[(E)-3-chloranyl-1-diethoxyphosphoryl-3-(4-methylphenyl)prop-2-enyl]-dimethyl-azanium perchlorate

Systemtic Name: [(E)-3-chloranyl-1-diethoxyphosphoryl-3-(4-methylphenyl)prop-2-enyl]-dimethyl-azanium perchlorate Openeye Name: [(E)-3-chloro-1-diethoxyphosphoryl-3-(p-tolyl)allyl]-dimethyl-ammonium perchlorate CAS Name: [(E)-3-chloro-1-diethoxyphosphoryl-3-(4-methylphenyl)prop-2-enyl]-dimethylammonium perchlorate IUPAC Name: [(E)-3-chloro-1-diethoxyphosphoryl-3-(4-methylphenyl)prop-2-enyl]-dimethylazanium perchlorate Traditional Name: [(E)-3-chloro-1-diethoxyphosphoryl-3-(p-tolyl)allyl]-dimethyl-ammonium perchlorate Formula: C16H26Cl2NO7P MolecularWeight: 446.259901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C=C(C1=CC=C(C=C1)C)Cl)[NH+](C)C)OCC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOP(=O)(C(/C=C(\C1=CC=C(C=C1)C)/Cl)[NH+](C)C)OCC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H25ClNO3P.ClHO4/c1-6-20-22(19,21-7-2)16(18(4)5)12-15(17)14-10-8-13(3)9-11-14;2-1(3,4)5/h8-12,16H,6-7H2,1-5H3;(H,2,3,4,5)/b15-12+;