4-[bis(4-dimethylaminophenyl)methylidene]-1,5-dimethyl-2-phenyl-pyrazol-1-ium-3-one

Systemtic Name: 4-[bis(4-dimethylaminophenyl)methylidene]-1,5-dimethyl-2-phenyl-pyrazol-1-ium-3-one Openeye Name: 4-[bis(4-dimethylaminophenyl)methylene]-1,5-dimethyl-2-phenyl-pyrazol-1-ium-3-one CAS Name: 4-[bis(4-dimethylaminophenyl)methylidene]-1,5-dimethyl-2-phenyl-3-pyrazol-1-iumone IUPAC Name: 4-[bis(4-dimethylaminophenyl)methylidene]-1,5-dimethyl-2-phenylpyrazol-1-ium-3-one Traditional Name: 4-[bis(4-dimethylaminophenyl)methylene]-1,5-dimethyl-2-phenyl-2-pyrazolin-1-ium-3-one Formula: C28H31N4O+ MolecularWeight: 439.57194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](N(C(=O)C1=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=[N+](N(C(=O)C1=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C28H31N4O/c1-20-26(28(33)32(31(20)6)25-10-8-7-9-11-25)27(21-12-16-23(17-13-21)29(2)3)22-14-18-24(19-15-22)30(4)5/h7-19H,1-6H3/q+1