3-(1,3-benzodioxol-5-yl)-2-(4-imidazol-1-ylphenyl)-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-(4-imidazol-1-ylphenyl)-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-(4-imidazol-1-ylphenyl)-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one CAS Name: 3-(1,3-benzodioxol-5-yl)-2-[4-(1-imidazolyl)phenyl]-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-(4-imidazol-1-ylphenyl)-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-(4-imidazol-1-ylphenyl)-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one Formula: C27H20N4O3 MolecularWeight: 448.4727

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(N1C3=CC=C(C=C3)N4C=CN=C4)C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C7C2=O

Isomeric SMILES

C1C2=C(C(N1C3=CC=C(C=C3)N4C=CN=C4)C5=CC6=C(C=C5)OCO6)NC7=CC=CC=C7C2=O

InChI

InChI=1S/C27H20N4O3/c32-27-20-3-1-2-4-22(20)29-25-21(27)14-31(19-8-6-18(7-9-19)30-12-11-28-15-30)26(25)17-5-10-23-24(13-17)34-16-33-23/h1-13,15,26H,14,16H2,(H,29,32)