3-(2-methoxy-7-oxidanylidene-6-phenyl-pteridin-8-yl)propanenitrile

Systemtic Name: 3-(2-methoxy-7-oxidanylidene-6-phenyl-pteridin-8-yl)propanenitrile Openeye Name: 3-(2-methoxy-7-oxo-6-phenyl-pteridin-8-yl)propanenitrile CAS Name: 3-(2-methoxy-7-oxo-6-phenyl-8-pteridinyl)propanenitrile IUPAC Name: 3-(2-methoxy-7-oxo-6-phenylpteridin-8-yl)propanenitrile Traditional Name: 3-(7-keto-2-methoxy-6-phenyl-pteridin-8-yl)propionitrile Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

Isomeric SMILES

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CC=C3)CCC#N

InChI

InChI=1S/C16H13N5O2/c1-23-16-18-10-12-14(20-16)21(9-5-8-17)15(22)13(19-12)11-6-3-2-4-7-11/h2-4,6-7,10H,5,9H2,1H3