8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one

Systemtic Name: 8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one Openeye Name: 8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one CAS Name: 8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one IUPAC Name: 8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one Traditional Name: 8-(3-bromophenyl)-8,10,11,12-tetrahydro-7H-benzo[a][4,7]phenanthrolin-9-one Formula: C22H17BrN2O MolecularWeight: 405.28718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(NC3=C2C4=C(C=C3)N=CC=C4)C5=CC(=CC=C5)Br)C(=O)C1

Isomeric SMILES

C1CC2=C(C(NC3=C2C4=C(C=C3)N=CC=C4)C5=CC(=CC=C5)Br)C(=O)C1

InChI

InChI=1S/C22H17BrN2O/c23-14-5-1-4-13(12-14)22-21-16(6-2-8-19(21)26)20-15-7-3-11-24-17(15)9-10-18(20)25-22/h1,3-5,7,9-12,22,25H,2,6,8H2