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

Systemtic Name: 7-oxidanylidene-6-phenylazanyl-1,2,3,4-tetrahydroazepine-5-carbonitrile Openeye Name: 6-anilino-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile CAS Name: 6-anilino-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile IUPAC Name: 6-anilino-7-oxo-1,2,3,4-tetrahydroazepine-5-carbonitrile Traditional Name: 6-anilino-7-keto-1,2,3,4-tetrahydroazepine-5-carbonitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=O)NC1)NC2=CC=CC=C2)C#N

Isomeric SMILES

C1CC(=C(C(=O)NC1)NC2=CC=CC=C2)C#N

InChI

InChI=1S/C13H13N3O/c14-9-10-5-4-8-15-13(17)12(10)16-11-6-2-1-3-7-11/h1-3,6-7,16H,4-5,8H2,(H,15,17)