3-[2-(3-chloranylphenoxy)-6-methyl-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[2-(3-chloranylphenoxy)-6-methyl-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[2-(3-chlorophenoxy)-6-methyl-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[2-(3-chlorophenoxy)-6-methyl-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[2-(3-chlorophenoxy)-6-methyl-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[2-(3-chlorophenoxy)-7-keto-6-methyl-pteridin-8-yl]propionitrile Formula: C16H12ClN5O2 MolecularWeight: 341.75178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CN=C(N=C2N(C1=O)CCC#N)OC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NC2=CN=C(N=C2N(C1=O)CCC#N)OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H12ClN5O2/c1-10-15(23)22(7-3-6-18)14-13(20-10)9-19-16(21-14)24-12-5-2-4-11(17)8-12/h2,4-5,8-9H,3,7H2,1H3