6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: 6-[3-(4-chlorophenyl)-6-phenyl-2H-1,2,4-triazin-5-ylidene]-4-hexyl-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C2C(=NNC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)C=C1O

Isomeric SMILES

CCCCCCC1=CC(=C2C(=NNC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)C=C1O

InChI

InChI=1S/C27H26ClN3O2/c1-2-3-4-6-11-20-16-22(24(33)17-23(20)32)26-25(18-9-7-5-8-10-18)30-31-27(29-26)19-12-14-21(28)15-13-19/h5,7-10,12-17,32H,2-4,6,11H2,1H3,(H,29,31)