2-(4-pyrrol-1-ylphenyl)-3,4-diazabicyclo[4.1.0]hept-2-en-5-one

Systemtic Name: 2-(4-pyrrol-1-ylphenyl)-3,4-diazabicyclo[4.1.0]hept-2-en-5-one Openeye Name: 2-(4-pyrrol-1-ylphenyl)-3,4-diazabicyclo[4.1.0]hept-2-en-5-one CAS Name: 2-[4-(1-pyrrolyl)phenyl]-3,4-diazabicyclo[4.1.0]hept-2-en-5-one IUPAC Name: 2-(4-pyrrol-1-ylphenyl)-3,4-diazabicyclo[4.1.0]hept-2-en-5-one Traditional Name: 2-(4-pyrrol-1-ylphenyl)-3,4-diazabicyclo[4.1.0]hept-2-en-5-one Formula: C15H13N3O MolecularWeight: 251.28322

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C1C(=O)NN=C2C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1C2C1C(=O)NN=C2C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C15H13N3O/c19-15-13-9-12(13)14(16-17-15)10-3-5-11(6-4-10)18-7-1-2-8-18/h1-8,12-13H,9H2,(H,17,19)