1-butyl-4-[2,3,4,5,6-pentakis(1-butylpyridin-4-ylidene)cyclohexylidene]pyridine

Systemtic Name: 1-butyl-4-[2,3,4,5,6-pentakis(1-butylpyridin-4-ylidene)cyclohexylidene]pyridine Openeye Name: 1-butyl-4-[2,3,4,5,6-pentakis(1-butyl-4-pyridylidene)cyclohexylidene]pyridine CAS Name: 1-butyl-4-[2,3,4,5,6-pentakis(1-butyl-4-pyridinylidene)cyclohexylidene]pyridine IUPAC Name: 1-butyl-4-[2,3,4,5,6-pentakis(1-butylpyridin-4-ylidene)cyclohexylidene]pyridine Traditional Name: 1-butyl-4-[2,3,4,5,6-pentakis(1-butyl-4-pyridylidene)cyclohexylidene]pyridine Formula: C60H78N6 MolecularWeight: 883.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=C2C(=C3C=CN(C=C3)CCCC)C(=C4C=CN(C=C4)CCCC)C(=C5C=CN(C=C5)CCCC)C(=C6C=CN(C=C6)CCCC)C2=C7C=CN(C=C7)CCCC)C=C1

Isomeric SMILES

CCCCN1C=CC(=C2C(=C3C=CN(C=C3)CCCC)C(=C4C=CN(C=C4)CCCC)C(=C5C=CN(C=C5)CCCC)C(=C6C=CN(C=C6)CCCC)C2=C7C=CN(C=C7)CCCC)C=C1

InChI

InChI=1S/C60H78N6/c1-7-13-31-61-37-19-49(20-38-61)55-56(50-21-39-62(40-22-50)32-14-8-2)58(52-25-43-64(44-26-52)34-16-10-4)60(54-29-47-66(48-30-54)36-18-12-6)59(53-27-45-65(46-28-53)35-17-11-5)57(55)51-23-41-63(42-24-51)33-15-9-3/h19-30,37-48H,7-18,31-36H2,1-6H3