4-[2,6-bis(2-ethylhexoxy)-10-(4-methanoylphenyl)anthracen-9-yl]benzaldehyde

Systemtic Name: 4-[2,6-bis(2-ethylhexoxy)-10-(4-methanoylphenyl)anthracen-9-yl]benzaldehyde Openeye Name: 4-[2,6-bis(2-ethylhexoxy)-10-(4-formylphenyl)-9-anthryl]benzaldehyde CAS Name: 4-[2,6-bis(2-ethylhexoxy)-10-(4-formylphenyl)-9-anthracenyl]benzaldehyde IUPAC Name: 4-[2,6-bis(2-ethylhexoxy)-10-(4-formylphenyl)anthracen-9-yl]benzaldehyde Traditional Name: 4-[2,6-bis(2-ethylhexoxy)-10-(4-formylphenyl)-9-anthryl]benzaldehyde Formula: C44H50O4 MolecularWeight: 642.8654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=CC2=C(C=C1)C(=C3C=C(C=CC3=C2C4=CC=C(C=C4)C=O)OCC(CC)CCCC)C5=CC=C(C=C5)C=O

Isomeric SMILES

CCCCC(CC)COC1=CC2=C(C=C1)C(=C3C=C(C=CC3=C2C4=CC=C(C=C4)C=O)OCC(CC)CCCC)C5=CC=C(C=C5)C=O

InChI

InChI=1S/C44H50O4/c1-5-9-11-31(7-3)29-47-37-21-23-39-41(25-37)43(35-17-13-33(27-45)14-18-35)40-24-22-38(48-30-32(8-4)12-10-6-2)26-42(40)44(39)36-19-15-34(28-46)16-20-36/h13-28,31-32H,5-12,29-30H2,1-4H3