2-(2-ethoxyphenyl)-4-oxidanylidene-1H-purino[9,8-a]pyridine-8-carbonitrile

Systemtic Name: 2-(2-ethoxyphenyl)-4-oxidanylidene-1H-purino[9,8-a]pyridine-8-carbonitrile Openeye Name: 2-(2-ethoxyphenyl)-4-oxo-1H-purino[9,8-a]pyridine-8-carbonitrile CAS Name: 2-(2-ethoxyphenyl)-4-oxo-1H-purino[9,8-a]pyridine-8-carbonitrile IUPAC Name: 2-(2-ethoxyphenyl)-4-oxo-1H-purino[9,8-a]pyridine-8-carbonitrile Traditional Name: 4-keto-2-o-phenetyl-1H-purino[9,8-a]pyridine-8-carbonitrile Formula: C18H13N5O2 MolecularWeight: 331.32812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)N4C=C(C=CC4=N3)C#N

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=O)C3=C(N2)N4C=C(C=CC4=N3)C#N

InChI

InChI=1S/C18H13N5O2/c1-2-25-13-6-4-3-5-12(13)16-21-17-15(18(24)22-16)20-14-8-7-11(9-19)10-23(14)17/h3-8,10H,2H2,1H3,(H,21,22,24)