[(Z)-4-(4-chlorophenyl)-2,3-dimethyl-but-2-enyl]-diethyl-heptyl-azanium chloride

Systemtic Name: [(Z)-4-(4-chlorophenyl)-2,3-dimethyl-but-2-enyl]-diethyl-heptyl-azanium chloride Openeye Name: [(Z)-4-(4-chlorophenyl)-2,3-dimethyl-but-2-enyl]-diethyl-heptyl-ammonium chloride CAS Name: [(Z)-4-(4-chlorophenyl)-2,3-dimethylbut-2-enyl]-diethyl-heptylammonium chloride IUPAC Name: [(Z)-4-(4-chlorophenyl)-2,3-dimethylbut-2-enyl]-diethyl-heptylazanium chloride Traditional Name: [(Z)-4-(4-chlorophenyl)-2,3-dimethyl-but-2-enyl]-diethyl-heptyl-ammonium chloride Formula: C23H39Cl2N MolecularWeight: 400.46846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CC)(CC)CC(=C(C)CC1=CC=C(C=C1)Cl)C.[Cl-]

Isomeric SMILES

CCCCCCC[N+](CC)(CC)C/C(=C(/C)\CC1=CC=C(C=C1)Cl)/C.[Cl-]

InChI

InChI=1S/C23H39ClN.ClH/c1-6-9-10-11-12-17-25(7-2,8-3)19-21(5)20(4)18-22-13-15-23(24)16-14-22;/h13-16H,6-12,17-19H2,1-5H3;1H/q+1;/p-1/b21-20-;