(5S)-5-methyl-1-(phenylmethylidene)pyrazolidin-1-ium-4-one

Systemtic Name: (5S)-5-methyl-1-(phenylmethylidene)pyrazolidin-1-ium-4-one Openeye Name: (5S)-1-benzylidene-5-methyl-pyrazolidin-1-ium-4-one CAS Name: (5S)-5-methyl-1-(phenylmethylene)-4-pyrazolidin-1-iumone IUPAC Name: (5S)-1-benzylidene-5-methylpyrazolidin-1-ium-4-one Traditional Name: (5S)-1-benzal-5-methyl-pyrazolidin-1-ium-4-one Formula: C11H13N2O+ MolecularWeight: 189.23372

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)CN[N+]1=CC2=CC=CC=C2

Isomeric SMILES

C[C@H]1C(=O)CN[N+]1=CC2=CC=CC=C2

InChI

InChI=1S/C11H13N2O/c1-9-11(14)7-12-13(9)8-10-5-3-2-4-6-10/h2-6,8-9,12H,7H2,1H3/q+1/t9-/m0/s1