[(E)-1-(3,4-dichlorophenyl)-8-methyl-3-oxidanylidene-non-1-en-4-yl]-dimethyl-azanium chloride

Systemtic Name: [(E)-1-(3,4-dichlorophenyl)-8-methyl-3-oxidanylidene-non-1-en-4-yl]-dimethyl-azanium chloride Openeye Name: [1-[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-5-methyl-hexyl]-dimethyl-ammonium chloride CAS Name: [(E)-1-(3,4-dichlorophenyl)-8-methyl-3-oxonon-1-en-4-yl]-dimethylammonium chloride IUPAC Name: [(E)-1-(3,4-dichlorophenyl)-8-methyl-3-oxonon-1-en-4-yl]-dimethylazanium chloride Traditional Name: [(E)-4-(3,4-dichlorophenyl)-1-isohexyl-2-keto-but-3-enyl]-dimethyl-ammonium chloride Formula: C18H26Cl3NO MolecularWeight: 378.76414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C(=O)C=CC1=CC(=C(C=C1)Cl)Cl)[NH+](C)C.[Cl-]

Isomeric SMILES

CC(C)CCCC(C(=O)/C=C/C1=CC(=C(C=C1)Cl)Cl)[NH+](C)C.[Cl-]

InChI

InChI=1S/C18H25Cl2NO.ClH/c1-13(2)6-5-7-17(21(3)4)18(22)11-9-14-8-10-15(19)16(20)12-14;/h8-13,17H,5-7H2,1-4H3;1H/b11-9+;