2-bromanyl-N-[4-(5-oxidanylidene-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butanamide

Systemtic Name: 2-bromanyl-N-[4-(5-oxidanylidene-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butanamide Openeye Name: 2-bromo-N-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butanamide CAS Name: 2-bromo-N-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butanamide IUPAC Name: 2-bromo-N-[4-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butanamide Traditional Name: 2-bromo-N-[4-(5-keto-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)phenyl]butyramide Formula: C15H16BrN3O2 MolecularWeight: 350.21044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C2=NNC(=O)C3C2C3)Br

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C2=NNC(=O)C3C2C3)Br

InChI

InChI=1S/C15H16BrN3O2/c1-2-12(16)15(21)17-9-5-3-8(4-6-9)13-10-7-11(10)14(20)19-18-13/h3-6,10-12H,2,7H2,1H3,(H,17,21)(H,19,20)