(1Z)-1-[(4-methoxyphenyl)methylidene]-5,5-dimethyl-pyrazolidin-1-ium-3-one

Systemtic Name: (1Z)-1-[(4-methoxyphenyl)methylidene]-5,5-dimethyl-pyrazolidin-1-ium-3-one Openeye Name: (1Z)-1-[(4-methoxyphenyl)methylene]-5,5-dimethyl-pyrazolidin-1-ium-3-one CAS Name: (1Z)-1-[(4-methoxyphenyl)methylidene]-5,5-dimethyl-3-pyrazolidin-1-iumone IUPAC Name: (1Z)-1-[(4-methoxyphenyl)methylidene]-5,5-dimethylpyrazolidin-1-ium-3-one Traditional Name: (1Z)-5,5-dimethyl-1-p-anisylidene-pyrazolidin-1-ium-3-one Formula: C13H17N2O2+ MolecularWeight: 233.28628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N[N+]1=CC2=CC=C(C=C2)OC)C

Isomeric SMILES

CC\1(CC(=O)N/[N+]1=C\C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C13H16N2O2/c1-13(2)8-12(16)14-15(13)9-10-4-6-11(17-3)7-5-10/h4-7,9H,8H2,1-3H3/p+1/b15-9-