3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene

Systemtic Name: 3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene Openeye Name: 3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene CAS Name: 3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene IUPAC Name: 3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene Traditional Name: 3,6-bis(3,4,5-tris-decoxyphenoxy)-9,10-bis[4-(3,4,5-tris-decoxyphenoxy)phenyl]phenanthrene Formula: C170H274O16 MolecularWeight: 2573.98496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCC)OCCCCCCCCCC)OC2=CC=C(C=C2)C3=C(C4=C(C=C(C=C4)OC5=CC(=C(C(=C5)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC)C6=C3C=CC(=C6)OC7=CC(=C(C(=C7)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC)C8=CC=C(C=C8)OC9=CC(=C(C(=C9)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCC)OCCCCCCCCCC)OC2=CC=C(C=C2)C3=C(C4=C(C=C(C=C4)OC5=CC(=C(C(=C5)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC)C6=C3C=CC(=C6)OC7=CC(=C(C(=C7)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC)C8=CC=C(C=C8)OC9=CC(=C(C(=C9)OCCCCCCCCCC)OCCCCCCCCCC)OCCCCCCCCCC

InChI

InChI=1S/C170H274O16/c1-13-25-37-49-61-73-85-97-121-171-157-135-149(136-158(172-122-98-86-74-62-50-38-26-14-2)167(157)179-129-105-93-81-69-57-45-33-21-9)183-145-113-109-143(110-114-145)165-153-119-117-147(185-151-139-161(175-125-101-89-77-65-53-41-29-17-5)169(181-131-107-95-83-71-59-47-35-23-11)162(140-151)176-126-102-90-78-66-54-42-30-18-6)133-155(153)156-134-148(186-152-141-163(177-127-103-91-79-67-55-43-31-19-7)170(182-132-108-96-84-72-60-48-36-24-12)164(142-152)178-128-104-92-80-68-56-44-32-20-8)118-120-154(156)166(165)144-111-115-146(116-112-144)184-150-137-159(173-123-99-87-75-63-51-39-27-15-3)168(180-130-106-94-82-70-58-46-34-22-10)160(138-150)174-124-100-88-76-64-52-40-28-16-4/h109-120,133-142H,13-108,121-132H2,1-12H3