6-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydroazepine-5-carbonitrile

Systemtic Name: 6-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydroazepine-5-carbonitrile Openeye Name: 6-hydroxy-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile CAS Name: 6-hydroxy-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile IUPAC Name: 6-hydroxy-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile Traditional Name: 6-hydroxy-7-keto-1,2,3,4-tetrahydroazepine-5-carbonitrile Formula: C7H8N2O2 MolecularWeight: 152.15062

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)NC1)O)C#N

Isomeric SMILES

C1CC(=C(C(=O)NC1)O)C#N

InChI

InChI=1S/C7H8N2O2/c8-4-5-2-1-3-9-7(11)6(5)10/h10H,1-3H2,(H,9,11)