(6Z)-3-(2-ethylhexoxy)-6-[(4E)-4-[4-(2-ethylhexoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-[1-(phenylmethyl)pyrrol-2-yl]-1H-1,3,5-triazin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-3-(2-ethylhexoxy)-6-[(4E)-4-[4-(2-ethylhexoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-[1-(phenylmethyl)pyrrol-2-yl]-1H-1,3,5-triazin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[(4E)-6-(1-benzylpyrrol-2-yl)-4-[4-(2-ethylhexoxy)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-1H-1,3,5-triazin-2-ylidene]-3-(2-ethylhexoxy)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-3-(2-ethylhexoxy)-6-[(4E)-4-[4-(2-ethylhexoxy)-6-oxo-1-cyclohexa-2,4-dienylidene]-6-[1-(phenylmethyl)-2-pyrrolyl]-1H-1,3,5-triazin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[(4E)-6-(1-benzylpyrrol-2-yl)-4-[4-(2-ethylhexoxy)-6-oxocyclohexa-2,4-dien-1-ylidene]-1H-1,3,5-triazin-2-ylidene]-3-(2-ethylhexoxy)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[(4E)-6-(1-benzylpyrrol-2-yl)-4-[4-(2-ethylhexoxy)-6-keto-cyclohexa-2,4-dien-1-ylidene]-1H-s-triazin-2-ylidene]-3-(2-ethylhexoxy)cyclohexa-2,4-dien-1-one Formula: C42H52N4O4 MolecularWeight: 676.88668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=CC(=O)C(=C2NC(=C3C=CC(=CC3=O)OCC(CC)CCCC)N=C(N2)C4=CC=CN4CC5=CC=CC=C5)C=C1

Isomeric SMILES

CCCCC(CC)COC1=CC(=O)/C(=C\2/N/C(=C\3/C=CC(=CC3=O)OCC(CC)CCCC)/N=C(N2)C4=CC=CN4CC5=CC=CC=C5)/C=C1

InChI

InChI=1S/C42H52N4O4/c1-5-9-15-30(7-3)28-49-33-20-22-35(38(47)25-33)40-43-41(36-23-21-34(26-39(36)48)50-29-31(8-4)16-10-6-2)45-42(44-40)37-19-14-24-46(37)27-32-17-12-11-13-18-32/h11-14,17-26,30-31,43H,5-10,15-16,27-29H2,1-4H3,(H,44,45)/b40-35-,41-36+