(4E)-2-ethyl-4-[[(2-ethylphenyl)amino]methylidene]-5-methyl-2-phenyl-pyrazol-2-ium-3-one

Systemtic Name: (4E)-2-ethyl-4-[[(2-ethylphenyl)amino]methylidene]-5-methyl-2-phenyl-pyrazol-2-ium-3-one Openeye Name: (4E)-2-ethyl-4-[(2-ethylanilino)methylene]-5-methyl-2-phenyl-pyrazol-2-ium-3-one CAS Name: (4E)-2-ethyl-4-[(2-ethylanilino)methylidene]-5-methyl-2-phenyl-3-pyrazol-2-iumone IUPAC Name: (4E)-2-ethyl-4-[(2-ethylanilino)methylidene]-5-methyl-2-phenylpyrazol-2-ium-3-one Traditional Name: (4E)-2-ethyl-4-[(2-ethylanilino)methylene]-5-methyl-2-phenyl-2-pyrazolin-2-ium-3-one Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC=C2C(=N[N+](C2=O)(CC)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC=CC=C1N/C=C/2\C(=N[N+](C2=O)(CC)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3O/c1-4-17-11-9-10-14-20(17)22-15-19-16(3)23-24(5-2,21(19)25)18-12-7-6-8-13-18/h6-15H,4-5H2,1-3H3/p+1