(4aR,8aS)-5-methylidene-2-oxidanylidene-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile

Systemtic Name: (4aR,8aS)-5-methylidene-2-oxidanylidene-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile Openeye Name: (4aR,8aS)-5-methylene-2-oxo-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile CAS Name: (4aR,8aS)-5-methylene-2-oxo-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile IUPAC Name: (4aR,8aS)-5-methylidene-2-oxo-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile Traditional Name: (4aR,8aS)-2-keto-5-methylene-1,4a,8,8a-tetrahydro-1,6-naphthyridine-3-carbonitrile Formula: C10H9N3O MolecularWeight: 187.19796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C2C=C(C(=O)NC2CC=N1)C#N

Isomeric SMILES

C=C1[C@@H]2C=C(C(=O)N[C@H]2CC=N1)C#N

InChI

InChI=1S/C10H9N3O/c1-6-8-4-7(5-11)10(14)13-9(8)2-3-12-6/h3-4,8-9H,1-2H2,(H,13,14)/t8-,9-/m0/s1