6-bromanyl-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one

Systemtic Name: 6-bromanyl-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one Openeye Name: 6-bromo-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one CAS Name: 6-bromo-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one IUPAC Name: 6-bromo-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one Traditional Name: 6-bromo-9a-propyl-2,8,9,10-tetrahydroindeno[2,1-e]benzotriazol-7-one Formula: C16H16BrN3O MolecularWeight: 346.22174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC12CCC(=O)C(=C1C3=C(C2)C4=NNN=C4C=C3)Br

Isomeric SMILES

CCCC12CCC(=O)C(=C1C3=C(C2)C4=NNN=C4C=C3)Br

InChI

InChI=1S/C16H16BrN3O/c1-2-6-16-7-5-12(21)14(17)13(16)9-3-4-11-15(10(9)8-16)19-20-18-11/h3-4H,2,5-8H2,1H3,(H,18,19,20)