6-[2,6-bis[(4-methylphenyl)carbonyl]-1H-1,3,5-triazin-4-ylidene]-3-octoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2,6-bis[(4-methylphenyl)carbonyl]-1H-1,3,5-triazin-4-ylidene]-3-octoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2,6-bis(4-methylbenzoyl)-1H-1,3,5-triazin-4-ylidene]-3-octoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[2,6-bis[(4-methylphenyl)-oxomethyl]-1H-1,3,5-triazin-4-ylidene]-3-octoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2,6-bis(4-methylbenzoyl)-1H-1,3,5-triazin-4-ylidene]-3-octoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[2,6-bis(p-toluoyl)-1H-s-triazin-4-ylidene]-3-octoxy-cyclohexa-2,4-dien-1-one Formula: C33H35N3O4 MolecularWeight: 537.6487

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=O)C(=C2N=C(NC(=N2)C(=O)C3=CC=C(C=C3)C)C(=O)C4=CC=C(C=C4)C)C=C1

Isomeric SMILES

CCCCCCCCOC1=CC(=O)C(=C2N=C(NC(=N2)C(=O)C3=CC=C(C=C3)C)C(=O)C4=CC=C(C=C4)C)C=C1

InChI

InChI=1S/C33H35N3O4/c1-4-5-6-7-8-9-20-40-26-18-19-27(28(37)21-26)31-34-32(29(38)24-14-10-22(2)11-15-24)36-33(35-31)30(39)25-16-12-23(3)13-17-25/h10-19,21H,4-9,20H2,1-3H3,(H,34,35,36)