4-[cyclohexa-2,5-dien-1-ylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one

Systemtic Name: 4-[cyclohexa-2,5-dien-1-ylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one Openeye Name: 4-[cyclohexa-2,5-dien-1-ylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one CAS Name: 4-[1-cyclohexa-2,5-dienylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazol-1-iumone IUPAC Name: 4-[cyclohexa-2,5-dien-1-ylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenylpyrazol-1-ium-3-one Traditional Name: 4-[cyclohexa-2,5-dien-1-ylidene(phenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazolin-1-ium-3-one Formula: C25H25N2O+ MolecularWeight: 369.4788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N([N+]1(C)C)C2=CC=CC=C2)C(=C3C=CCC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N([N+]1(C)C)C2=CC=CC=C2)C(=C3C=CCC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N2O/c1-19-23(25(28)26(27(19,2)3)22-17-11-6-12-18-22)24(20-13-7-4-8-14-20)21-15-9-5-10-16-21/h4,6-18H,5H2,1-3H3/q+1