3-[[2-(3-chloranyl-5-methoxy-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxy-benzenecarbonitrile

Systemtic Name: 3-[[2-(3-chloranyl-5-methoxy-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxy-benzenecarbonitrile Openeye Name: 3-[[2-(3-chloro-5-methoxy-phenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxy-benzonitrile CAS Name: 3-[[2-(3-chloro-5-methoxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxybenzonitrile IUPAC Name: 3-[[2-(3-chloro-5-methoxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxybenzonitrile Traditional Name: 3-[[2-(3-chloro-5-methoxy-phenoxy)-6-keto-7,8-dihydro-5H-pteridin-4-yl]oxy]-4-ethoxy-benzonitrile Formula: C22H18ClN5O5 MolecularWeight: 467.86182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C#N)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC(=CC(=C4)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C#N)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC(=CC(=C4)Cl)OC

InChI

InChI=1S/C22H18ClN5O5/c1-3-31-16-5-4-12(10-24)6-17(16)33-21-19-20(25-11-18(29)26-19)27-22(28-21)32-15-8-13(23)7-14(9-15)30-2/h4-9H,3,11H2,1-2H3,(H,26,29)(H,25,27,28)