(6E)-6-(2-butyl-4-ethyl-2-pyridin-4-yl-1H-pyrazol-2-ium-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(2-butyl-4-ethyl-2-pyridin-4-yl-1H-pyrazol-2-ium-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-butyl-4-ethyl-2-(4-pyridyl)-1H-pyrazol-2-ium-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(2-butyl-4-ethyl-2-pyridin-4-yl-1H-pyrazol-2-ium-3-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(2-butyl-4-ethyl-2-pyridin-4-yl-1H-pyrazol-2-ium-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-butyl-4-ethyl-2-(4-pyridyl)-3-pyrazolin-2-ium-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C20H24N3O+ MolecularWeight: 322.42406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C(=C2C=CC=CC2=O)C(=CN1)CC)C3=CC=NC=C3

Isomeric SMILES

CCCC[N+]1(/C(=C/2\C=CC=CC2=O)/C(=CN1)CC)C3=CC=NC=C3

InChI

InChI=1S/C20H23N3O/c1-3-5-14-23(17-10-12-21-13-11-17)20(16(4-2)15-22-23)18-8-6-7-9-19(18)24/h6-13,15H,3-5,14H2,1-2H3/p+1