3,5-bis[3-(2-adamantylidene)-5-iodanyl-penta-1,4-diynyl]pyridine

Systemtic Name: 3,5-bis[3-(2-adamantylidene)-5-iodanyl-penta-1,4-diynyl]pyridine Openeye Name: 3,5-bis[3-(2-adamantylidene)-5-iodo-penta-1,4-diynyl]pyridine CAS Name: 3,5-bis[3-(2-adamantylidene)-5-iodopenta-1,4-diynyl]pyridine IUPAC Name: 3,5-bis[3-(2-adamantylidene)-5-iodopenta-1,4-diynyl]pyridine Traditional Name: 3,5-bis[3-(2-adamantylidene)-5-iodo-penta-1,4-diynyl]pyridine Formula: C35H31I2N MolecularWeight: 719.43628

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3=C(C#CC4=CC(=CN=C4)C#CC(=C5C6CC7CC(C6)CC5C7)C#CI)C#CI

Isomeric SMILES

C1C2CC3CC1CC(C2)C3=C(C#CC4=CC(=CN=C4)C#CC(=C5C6CC7CC(C6)CC5C7)C#CI)C#CI

InChI

InChI=1S/C35H31I2N/c36-7-5-28(34-30-12-24-10-25(14-30)15-31(34)13-24)3-1-22-9-23(21-38-20-22)2-4-29(6-8-37)35-32-16-26-11-27(18-32)19-33(35)17-26/h9,20-21,24-27,30-33H,10-19H2