3-[2-(4-methoxyphenoxy)-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[2-(4-methoxyphenoxy)-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[2-(4-methoxyphenoxy)-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[2-(4-methoxyphenoxy)-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[2-(4-methoxyphenoxy)-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[7-keto-2-(4-methoxyphenoxy)pteridin-8-yl]propionitrile Formula: C16H13N5O3 MolecularWeight: 323.30612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=C3C(=N2)N(C(=O)C=N3)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=C3C(=N2)N(C(=O)C=N3)CCC#N

InChI

InChI=1S/C16H13N5O3/c1-23-11-3-5-12(6-4-11)24-16-19-9-13-15(20-16)21(8-2-7-17)14(22)10-18-13/h3-6,9-10H,2,8H2,1H3