2-[4-[15-(4-iodophenyl)-10,20-di(tridecan-7-yl)-23,24-dihydroporphyrin-5-yl]phenyl]ethynyl-trimethyl-silane

Systemtic Name: 2-[4-[15-(4-iodophenyl)-10,20-di(tridecan-7-yl)-23,24-dihydroporphyrin-5-yl]phenyl]ethynyl-trimethyl-silane Openeye Name: 2-[4-[10,20-bis(1-hexylheptyl)-15-(4-iodophenyl)-23,24-dihydroporphyrin-5-yl]phenyl]ethynyl-trimethyl-silane CAS Name: 2-[4-[15-(4-iodophenyl)-10,20-di(tridecan-7-yl)-23,24-dihydroporphyrin-5-yl]phenyl]ethynyl-trimethylsilane IUPAC Name: 2-[4-[15-(4-iodophenyl)-10,20-di(tridecan-7-yl)-23,24-dihydroporphyrin-5-yl]phenyl]ethynyl-trimethylsilane Traditional Name: 2-[4-[10,20-bis(1-hexylheptyl)-15-(4-iodophenyl)-23,24-dihydroporphin-5-yl]phenyl]ethynyl-trimethyl-silane Formula: C63H81IN4Si MolecularWeight: 1049.33401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCC)C1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6=CC=C(C=C6)C#C[Si](C)(C)C)C(CCCCCC)CCCCCC)C7=CC=C(C=C7)I)N2

Isomeric SMILES

CCCCCCC(CCCCCC)C1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6=CC=C(C=C6)C#C[Si](C)(C)C)C(CCCCCC)CCCCCC)C7=CC=C(C=C7)I)N2

InChI

InChI=1S/C63H81IN4Si/c1-8-12-16-20-24-47(25-21-17-13-9-2)60-52-36-40-56(65-52)62(49-30-28-46(29-31-49)44-45-69(5,6)7)57-41-37-53(66-57)61(48(26-22-18-14-10-3)27-23-19-15-11-4)55-39-43-59(68-55)63(58-42-38-54(60)67-58)50-32-34-51(64)35-33-50/h28-43,47-48,67-68H,8-27H2,1-7H3