ethyl 11-cyano-4-oxidanylidene-7,8,9,10-tetrahydropyrimido[1,2-b]isoquinoline-3-carboxylate

Systemtic Name: ethyl 11-cyano-4-oxidanylidene-7,8,9,10-tetrahydropyrimido[1,2-b]isoquinoline-3-carboxylate Openeye Name: ethyl 11-cyano-4-oxo-7,8,9,10-tetrahydropyrimido[1,2-b]isoquinoline-3-carboxylate CAS Name: 11-cyano-4-oxo-7,8,9,10-tetrahydropyrimido[1,2-b]isoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 11-cyano-4-oxo-7,8,9,10-tetrahydropyrimido[1,2-b]isoquinoline-3-carboxylate Traditional Name: 11-cyano-4-keto-7,8,9,10-tetrahydropyrimid[1,2-b]isoquinoline-3-carboxylic acid ethyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C3CCCCC3=CN2C1=O)C#N

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C3CCCCC3=CN2C1=O)C#N

InChI

InChI=1S/C16H15N3O3/c1-2-22-16(21)13-8-18-14-12(7-17)11-6-4-3-5-10(11)9-19(14)15(13)20/h8-9H,2-6H2,1H3