4-tert-butyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile

Systemtic Name: 4-tert-butyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile Openeye Name: 4-tert-butyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile CAS Name: 4-tert-butyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile IUPAC Name: 4-tert-butyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile Traditional Name: 4-tert-butyl-2,5-diketo-1,3-dihydro-1,4-benzodiazepine-7-carbonitrile Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(=O)NC2=C(C1=O)C=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)N1CC(=O)NC2=C(C1=O)C=C(C=C2)C#N

InChI

InChI=1S/C14H15N3O2/c1-14(2,3)17-8-12(18)16-11-5-4-9(7-15)6-10(11)13(17)19/h4-6H,8H2,1-3H3,(H,16,18)