2-(10-cyano-4-oxidanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]indolizin-3-yl)ethanoate

Systemtic Name: 2-(10-cyano-4-oxidanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]indolizin-3-yl)ethanoate Openeye Name: 2-(10-cyano-4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]indolizin-3-yl)acetate CAS Name: 2-(10-cyano-4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]indolizin-3-yl)acetate IUPAC Name: 2-(10-cyano-4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]indolizin-3-yl)acetate Traditional Name: 2-(10-cyano-4-keto-6,7,8,9-tetrahydropyrimid[4,5-b]indolizin-3-yl)acetate Formula: C13H11N4O3- MolecularWeight: 271.25144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=C(C3=C2C(=O)N(C=N3)CC(=O)[O-])C#N)C1

Isomeric SMILES

C1CCN2C(=C(C3=C2C(=O)N(C=N3)CC(=O)[O-])C#N)C1

InChI

InChI=1S/C13H12N4O3/c14-5-8-9-3-1-2-4-17(9)12-11(8)15-7-16(13(12)20)6-10(18)19/h7H,1-4,6H2,(H,18,19)/p-1