9-heptyl-3-[2-(9-heptylcarbazol-3-yl)ethynyl]-6-iodanyl-carbazole

Systemtic Name: 9-heptyl-3-[2-(9-heptylcarbazol-3-yl)ethynyl]-6-iodanyl-carbazole Openeye Name: 9-heptyl-3-[2-(9-heptylcarbazol-3-yl)ethynyl]-6-iodo-carbazole CAS Name: 9-heptyl-3-[2-(9-heptyl-3-carbazolyl)ethynyl]-6-iodocarbazole IUPAC Name: 9-heptyl-3-[2-(9-heptylcarbazol-3-yl)ethynyl]-6-iodocarbazole Traditional Name: 9-heptyl-3-[2-(9-heptylcarbazol-3-yl)ethynyl]-6-iodo-carbazole Formula: C40H43IN2 MolecularWeight: 678.68729

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=C(C=C(C=C2)C#CC3=CC4=C(C=C3)N(C5=CC=CC=C54)CCCCCCC)C6=C1C=CC(=C6)I

Isomeric SMILES

CCCCCCCN1C2=C(C=C(C=C2)C#CC3=CC4=C(C=C3)N(C5=CC=CC=C54)CCCCCCC)C6=C1C=CC(=C6)I

InChI

InChI=1S/C40H43IN2/c1-3-5-7-9-13-25-42-37-16-12-11-15-33(37)34-27-30(19-22-38(34)42)17-18-31-20-23-39-35(28-31)36-29-32(41)21-24-40(36)43(39)26-14-10-8-6-4-2/h11-12,15-16,19-24,27-29H,3-10,13-14,25-26H2,1-2H3