(1E)-1-[(4-dimethylaminophenyl)methylidene]pyrazolidin-1-ium-3-one

Systemtic Name: (1E)-1-[(4-dimethylaminophenyl)methylidene]pyrazolidin-1-ium-3-one Openeye Name: (1E)-1-[(4-dimethylaminophenyl)methylene]pyrazolidin-1-ium-3-one CAS Name: (1E)-1-[(4-dimethylaminophenyl)methylidene]-3-pyrazolidin-1-iumone IUPAC Name: (1E)-1-[(4-dimethylaminophenyl)methylidene]pyrazolidin-1-ium-3-one Traditional Name: (1E)-1-[4-(dimethylamino)benzylidene]pyrazolidin-1-ium-3-one Formula: C12H16N3O+ MolecularWeight: 218.27494

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=[N+]2CCC(=O)N2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=[N+]/2\CCC(=O)N2

InChI

InChI=1S/C12H15N3O/c1-14(2)11-5-3-10(4-6-11)9-15-8-7-12(16)13-15/h3-6,9H,7-8H2,1-2H3/p+1