4,7-bis[4-(9-penta-1,4-dien-3-yloxynonoxy)phenyl]-2,1,3-benzothiadiazole

Systemtic Name: 4,7-bis[4-(9-penta-1,4-dien-3-yloxynonoxy)phenyl]-2,1,3-benzothiadiazole Openeye Name: 4,7-bis[4-[9-(1-vinylallyloxy)nonoxy]phenyl]-2,1,3-benzothiadiazole CAS Name: 4,7-bis[4-(9-penta-1,4-dien-3-yloxynonoxy)phenyl]-2,1,3-benzothiadiazole IUPAC Name: 4,7-bis[4-(9-penta-1,4-dien-3-yloxynonoxy)phenyl]-2,1,3-benzothiadiazole Traditional Name: 4,7-bis[4-[9-(1-vinylallyloxy)nonoxy]phenyl]piazthiole Formula: C46H60N2O4S MolecularWeight: 737.0446

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C=C)OCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C3=NSN=C23)C4=CC=C(C=C4)OCCCCCCCCCOC(C=C)C=C

Isomeric SMILES

C=CC(C=C)OCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C3=NSN=C23)C4=CC=C(C=C4)OCCCCCCCCCOC(C=C)C=C

InChI

InChI=1S/C46H60N2O4S/c1-5-39(6-2)49-33-19-15-11-9-13-17-21-35-51-41-27-23-37(24-28-41)43-31-32-44(46-45(43)47-53-48-46)38-25-29-42(30-26-38)52-36-22-18-14-10-12-16-20-34-50-40(7-3)8-4/h5-8,23-32,39-40H,1-4,9-22,33-36H2