(3S,4S)-2-[azanyl(phenyl)methylidene]-3,4,5-trimethyl-4H-pyrazol-2-ium-3-ol

Systemtic Name: (3S,4S)-2-[azanyl(phenyl)methylidene]-3,4,5-trimethyl-4H-pyrazol-2-ium-3-ol Openeye Name: (3S,4S)-2-[amino(phenyl)methylene]-3,4,5-trimethyl-4H-pyrazol-2-ium-3-ol CAS Name: (3S,4S)-2-[amino(phenyl)methylidene]-3,4,5-trimethyl-4H-pyrazol-2-ium-3-ol IUPAC Name: (3S,4S)-2-[amino(phenyl)methylidene]-3,4,5-trimethyl-4H-pyrazol-2-ium-3-ol Traditional Name: (3S,4S)-2-[amino(phenyl)methylene]-3,4,5-trimethyl-2-pyrazolin-2-ium-3-ol Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=N[N+](=C(C2=CC=CC=C2)N)C1(C)O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-9-10(2)15-16(13(9,3)17)12(14)11-7-5-4-6-8-11/h4-9,14,17H,1-3H3/p+1/t9-,13-/m0/s1