1-(2,4-dichlorophenyl)-2-(4-prop-2-enyl-1,2,4-triazol-4-ium-1-yl)ethanone

Systemtic Name: 1-(2,4-dichlorophenyl)-2-(4-prop-2-enyl-1,2,4-triazol-4-ium-1-yl)ethanone Openeye Name: 2-(4-allyl-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dichlorophenyl)ethanone CAS Name: 1-(2,4-dichlorophenyl)-2-(4-prop-2-enyl-1,2,4-triazol-4-ium-1-yl)ethanone IUPAC Name: 1-(2,4-dichlorophenyl)-2-(4-prop-2-enyl-1,2,4-triazol-4-ium-1-yl)ethanone Traditional Name: 2-(4-allyl-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dichlorophenyl)ethanone Formula: C13H12Cl2N3O+ MolecularWeight: 297.15988

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=CN(N=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C=CC[N+]1=CN(N=C1)CC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H12Cl2N3O/c1-2-5-17-8-16-18(9-17)7-13(19)11-4-3-10(14)6-12(11)15/h2-4,6,8-9H,1,5,7H2/q+1