4-[2,6-bis(2,4-diethylphenyl)-1H-1,3,5-triazin-4-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2,6-bis(2,4-diethylphenyl)-1H-1,3,5-triazin-4-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2,6-bis(2,4-diethylphenyl)-1H-1,3,5-triazin-4-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[2,6-bis(2,4-diethylphenyl)-1H-1,3,5-triazin-4-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2,6-bis(2,4-diethylphenyl)-1H-1,3,5-triazin-4-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[2,6-bis(2,4-diethylphenyl)-1H-s-triazin-4-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C2=NC(=C3C=CC(=O)C=C3O)N=C(N2)C4=C(C=C(C=C4)CC)CC)CC

Isomeric SMILES

CCC1=CC(=C(C=C1)C2=NC(=C3C=CC(=O)C=C3O)N=C(N2)C4=C(C=C(C=C4)CC)CC)CC

InChI

InChI=1S/C29H31N3O2/c1-5-18-9-12-23(20(7-3)15-18)27-30-28(24-13-10-19(6-2)16-21(24)8-4)32-29(31-27)25-14-11-22(33)17-26(25)34/h9-17,34H,5-8H2,1-4H3,(H,30,31,32)