2-[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)chromen-6-yl]oxyethanenitrile

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)chromen-6-yl]oxyethanenitrile Openeye Name: 2-[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)chromen-6-yl]oxyacetonitrile CAS Name: 2-[[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)-1-benzopyran-6-yl]oxy]acetonitrile IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)chromen-6-yl]oxyacetonitrile Traditional Name: 2-[4-(1,3-benzodioxol-5-ylimino)-2-(4-methoxyphenyl)chromen-6-yl]oxyacetonitrile Formula: C25H18N2O5 MolecularWeight: 426.42082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC3=CC4=C(C=C3)OCO4)C5=C(O2)C=CC(=C5)OCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC3=CC4=C(C=C3)OCO4)C5=C(O2)C=CC(=C5)OCC#N

InChI

InChI=1S/C25H18N2O5/c1-28-18-5-2-16(3-6-18)24-14-21(27-17-4-8-23-25(12-17)31-15-30-23)20-13-19(29-11-10-26)7-9-22(20)32-24/h2-9,12-14H,11,15H2,1H3