2-[2-azanyl-4-(4-ethoxyphenyl)-3-methyl-imidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone

Systemtic Name: 2-[2-azanyl-4-(4-ethoxyphenyl)-3-methyl-imidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone Openeye Name: 2-[2-amino-4-(4-ethoxyphenyl)-3-methyl-imidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone CAS Name: 2-[2-amino-4-(4-ethoxyphenyl)-3-methyl-1-imidazol-1-iumyl]-1-(3,4-dichlorophenyl)ethanone IUPAC Name: 2-[2-amino-4-(4-ethoxyphenyl)-3-methylimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone Traditional Name: 2-(2-amino-3-methyl-4-p-phenetyl-imidazol-1-ium-1-yl)-1-(3,4-dichlorophenyl)ethanone Formula: C20H20Cl2N3O2+ MolecularWeight: 405.2977

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C[N+](=C(N2C)N)CC(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C[N+](=C(N2C)N)CC(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3O2/c1-3-27-15-7-4-13(5-8-15)18-11-25(20(23)24(18)2)12-19(26)14-6-9-16(21)17(22)10-14/h4-11,23H,3,12H2,1-2H3/p+1