2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)ethenyl]pyrazine

Systemtic Name: 2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)ethenyl]pyrazine Openeye Name: 2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)vinyl]pyrazine CAS Name: 2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)ethenyl]pyrazine IUPAC Name: 2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)ethenyl]pyrazine Traditional Name: 2,3,5,6-tetrakis[(E)-2-(3-cyclohexylphenyl)vinyl]pyrazine Formula: C60H68N2 MolecularWeight: 817.19532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=CC(=C2)C=CC3=C(N=C(C(=N3)C=CC4=CC(=CC=C4)C5CCCCC5)C=CC6=CC(=CC=C6)C7CCCCC7)C=CC8=CC(=CC=C8)C9CCCCC9

Isomeric SMILES

C1CCC(CC1)C2=CC=CC(=C2)/C=C/C3=C(N=C(C(=N3)/C=C/C4=CC(=CC=C4)C5CCCCC5)/C=C/C6=CC(=CC=C6)C7CCCCC7)/C=C/C8=CC(=CC=C8)C9CCCCC9

InChI

InChI=1S/C60H68N2/c1-5-21-49(22-6-1)53-29-13-17-45(41-53)33-37-57-58(38-34-46-18-14-30-54(42-46)50-23-7-2-8-24-50)62-60(40-36-48-20-16-32-56(44-48)52-27-11-4-12-28-52)59(61-57)39-35-47-19-15-31-55(43-47)51-25-9-3-10-26-51/h13-20,29-44,49-52H,1-12,21-28H2/b37-33+,38-34+,39-35+,40-36+