(Z)-2-(6-methylpyridin-2-yl)-3-(3,4,5-tris-decoxyphenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-(6-methylpyridin-2-yl)-3-(3,4,5-tris-decoxyphenyl)prop-2-enenitrile Openeye Name: (Z)-2-(6-methyl-2-pyridyl)-3-(3,4,5-tris-decoxyphenyl)prop-2-enenitrile CAS Name: (Z)-2-(6-methyl-2-pyridinyl)-3-(3,4,5-tris-decoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-2-(6-methylpyridin-2-yl)-3-(3,4,5-tris-decoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-2-(6-methyl-2-pyridyl)-3-(3,4,5-tris-decoxyphenyl)acrylonitrile Formula: C45H72N2O3 MolecularWeight: 689.06478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCC)OCCCCCCCCCC)C=C(C#N)C2=NC(=CC=C2)C

Isomeric SMILES

CCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCC)OCCCCCCCCCC)/C=C(\C#N)/C2=NC(=CC=C2)C

InChI

InChI=1S/C45H72N2O3/c1-5-8-11-14-17-20-23-26-32-48-43-36-40(35-41(38-46)42-31-29-30-39(4)47-42)37-44(49-33-27-24-21-18-15-12-9-6-2)45(43)50-34-28-25-22-19-16-13-10-7-3/h29-31,35-37H,5-28,32-34H2,1-4H3/b41-35+