2-[5-(cyanomethoxy)-4-methyl-2-oxidanylidene-3-phenethyl-chromen-7-yl]oxyethanenitrile

Systemtic Name: 2-[5-(cyanomethoxy)-4-methyl-2-oxidanylidene-3-phenethyl-chromen-7-yl]oxyethanenitrile Openeye Name: 2-[5-(cyanomethoxy)-4-methyl-2-oxo-3-phenethyl-chromen-7-yl]oxyacetonitrile CAS Name: 2-[[5-(cyanomethoxy)-4-methyl-2-oxo-3-phenethyl-1-benzopyran-7-yl]oxy]acetonitrile IUPAC Name: 2-[5-(cyanomethoxy)-4-methyl-2-oxo-3-phenethylchromen-7-yl]oxyacetonitrile Traditional Name: 2-[5-(cyanomethoxy)-2-keto-4-methyl-3-phenethyl-chromen-7-yl]oxyacetonitrile Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)OCC#N)OCC#N)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)OCC#N)OCC#N)CCC3=CC=CC=C3

InChI

InChI=1S/C22H18N2O4/c1-15-18(8-7-16-5-3-2-4-6-16)22(25)28-20-14-17(26-11-9-23)13-19(21(15)20)27-12-10-24/h2-6,13-14H,7-8,11-12H2,1H3