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

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

Systemtic Name:4-[cyclohexa-2,5-dien-1-ylidene-(3-nitrophenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one
Openeye Name:4-[cyclohexa-2,5-dien-1-ylidene-(3-nitrophenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one
CAS Name:4-[1-cyclohexa-2,5-dienylidene-(3-nitrophenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazol-1-iumone
IUPAC Name:4-[cyclohexa-2,5-dien-1-ylidene-(3-nitrophenyl)methyl]-1,1,5-trimethyl-2-phenylpyrazol-1-ium-3-one
Traditional Name:4-[cyclohexa-2,5-dien-1-ylidene-(3-nitrophenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazolin-1-ium-3-one
Formula: C25H24N3O3+
MolecularWeight: 414.47636
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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)[N+](=O)[O-]


Isomeric SMILES

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


InChI

InChI=1S/C25H24N3O3/c1-18-23(25(29)26(28(18,2)3)21-14-8-5-9-15-21)24(19-11-6-4-7-12-19)20-13-10-16-22(17-20)27(30)31/h5-17H,4H2,1-3H3/q+1


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