6-[5-(4-tert-butylphenyl)-1,2-dihydropyrazol-3-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(4-tert-butylphenyl)-1,2-dihydropyrazol-3-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(4-tert-butylphenyl)-1,2-dihydropyrazol-3-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: 6-[5-(4-tert-butylphenyl)-1,2-dihydropyrazol-3-ylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(4-tert-butylphenyl)-1,2-dihydropyrazol-3-ylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: 6-[5-(4-tert-butylphenyl)-3-pyrazolin-3-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C19H19ClN2O MolecularWeight: 326.81996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=C3C=C(C=CC3=O)Cl)NN2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=C3C=C(C=CC3=O)Cl)NN2

InChI

InChI=1S/C19H19ClN2O/c1-19(2,3)13-6-4-12(5-7-13)16-11-17(22-21-16)15-10-14(20)8-9-18(15)23/h4-11,21-22H,1-3H3