2-[2,6-bis[(E)-2-(1-hexylindol-3-yl)ethenyl]pyran-4-ylidene]propanedinitrile

Systemtic Name: 2-[2,6-bis[(E)-2-(1-hexylindol-3-yl)ethenyl]pyran-4-ylidene]propanedinitrile Openeye Name: 2-[2,6-bis[(E)-2-(1-hexylindol-3-yl)vinyl]pyran-4-ylidene]propanedinitrile CAS Name: 2-[2,6-bis[(E)-2-(1-hexyl-3-indolyl)ethenyl]-4-pyranylidene]propanedinitrile IUPAC Name: 2-[2,6-bis[(E)-2-(1-hexylindol-3-yl)ethenyl]pyran-4-ylidene]propanedinitrile Traditional Name: 2-[2,6-bis[(E)-2-(1-hexylindol-3-yl)vinyl]pyran-4-ylidene]malononitrile Formula: C40H42N4O MolecularWeight: 594.78768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C2=CC=CC=C21)C=CC3=CC(=C(C#N)C#N)C=C(O3)C=CC4=CN(C5=CC=CC=C54)CCCCCC

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=C1)/C=C/C3=CC(=C(C#N)C#N)C=C(O3)/C=C/C4=CN(C5=CC=CC=C45)CCCCCC

InChI

InChI=1S/C40H42N4O/c1-3-5-7-13-23-43-29-31(37-15-9-11-17-39(37)43)19-21-35-25-33(34(27-41)28-42)26-36(45-35)22-20-32-30-44(24-14-8-6-4-2)40-18-12-10-16-38(32)40/h9-12,15-22,25-26,29-30H,3-8,13-14,23-24H2,1-2H3/b21-19+,22-20+