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zinc 5-(5-bromanyl-4-dodecyl-thiophen-2-yl)-10,20-bis(3,5-ditert-butylphenyl)-15-[5-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]-4-dodecyl-thiophen-2-yl]porphyrin-23,24-diide

Systemtic Name:	zinc 5-(5-bromanyl-4-dodecyl-thiophen-2-yl)-10,20-bis(3,5-ditert-butylphenyl)-15-[5-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]-4-dodecyl-thiophen-2-yl]porphyrin-23,24-diide
Openeye Name:	zinc 5-[5-[4-[2,6-bis(2-pyridyl)-4-pyridyl]phenyl]-4-dodecyl-2-thienyl]-15-(5-bromo-4-dodecyl-2-thienyl)-10,20-bis(3,5-ditert-butylphenyl)porphyrin-21,22-diide
CAS Name:	zinc 5-[5-[4-[2,6-bis(2-pyridinyl)-4-pyridinyl]phenyl]-4-dodecyl-2-thiophenyl]-15-(5-bromo-4-dodecyl-2-thiophenyl)-10,20-bis(3,5-ditert-butylphenyl)porphyrin-21,22-diide
IUPAC Name:	zinc 5-(5-bromo-4-dodecylthiophen-2-yl)-10,20-bis(3,5-ditert-butylphenyl)-15-[5-[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]-4-dodecylthiophen-2-yl]porphyrin-23,24-diide
Traditional Name:	zinc 5-[5-[4-[2,6-bis(2-pyridyl)-4-pyridyl]phenyl]-4-lauryl-2-thienyl]-15-(5-bromo-4-lauryl-2-thienyl)-10,20-bis(3,5-ditert-butylphenyl)porphine-21,22-diide
Formula:	C₁₀₁H₁₁₆BrN₇S₂Zn
MolecularWeight:	1637.49164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(SC(=C1)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2[N-]6)C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)C=C5)C8=CC(=C(S8)Br)CCCCCCCCCCCC)C=C4)C9=CC(=CC(=C9)C(C)(C)C)C(C)(C)C)[N-]3)C1=CC=C(C=C1)C1=CC(=NC(=C1)C1=CC=CC=N1)C1=CC=CC=N1.[Zn+2]

Isomeric SMILES

InChI

InChI=1S/C101H116BrN7S2.Zn/c1-15-17-19-21-23-25-27-29-31-33-39-69-63-90(110-96(69)68-45-43-67(44-46-68)71-61-88(78-41-35-37-55-103-78)109-89(62-71)79-42-36-38-56-104-79)94-84-51-47-80(105-84)92(72-57-74(98(3,4)5)65-75(58-72)99(6,7)8)82-49-53-86(107-82)95(91-64-70(97(102)111-91)40-34-32-30-28-26-24-22-20-18-16-2)87-54-50-83(108-87)93(81-48-52-85(94)106-81)73-59-76(100(9,10)11)66-77(60-73)101(12,13)14;/h35-38,41-66H,15-34,39-40H2,1-14H3;/q-2;+2

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