2,6-bis[2-(10-ethynyl-9,10-dimethoxy-anthracen-9-yl)ethynyl]-4-octoxy-pyridine

Systemtic Name: 2,6-bis[2-(10-ethynyl-9,10-dimethoxy-anthracen-9-yl)ethynyl]-4-octoxy-pyridine Openeye Name: 2,6-bis[2-(10-ethynyl-9,10-dimethoxy-9-anthryl)ethynyl]-4-octoxy-pyridine CAS Name: 2,6-bis[2-(10-ethynyl-9,10-dimethoxy-9-anthracenyl)ethynyl]-4-octoxypyridine IUPAC Name: 2,6-bis[2-(10-ethynyl-9,10-dimethoxyanthracen-9-yl)ethynyl]-4-octoxypyridine Traditional Name: 2,6-bis[2-(10-ethynyl-9,10-dimethoxy-9-anthryl)ethynyl]-4-octoxy-pyridine Formula: C53H49NO5 MolecularWeight: 779.95986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=NC(=C1)C#CC2(C3=CC=CC=C3C(C4=CC=CC=C42)(C#C)OC)OC)C#CC5(C6=CC=CC=C6C(C7=CC=CC=C75)(C#C)OC)OC

Isomeric SMILES

CCCCCCCCOC1=CC(=NC(=C1)C#CC2(C3=CC=CC=C3C(C4=CC=CC=C42)(C#C)OC)OC)C#CC5(C6=CC=CC=C6C(C7=CC=CC=C75)(C#C)OC)OC

InChI

InChI=1S/C53H49NO5/c1-8-11-12-13-14-23-36-59-41-37-39(32-34-52(57-6)46-28-19-15-24-42(46)50(9-2,55-4)43-25-16-20-29-47(43)52)54-40(38-41)33-35-53(58-7)48-30-21-17-26-44(48)51(10-3,56-5)45-27-18-22-31-49(45)53/h2-3,15-22,24-31,37-38H,8,11-14,23,36H2,1,4-7H3