6-(hydroxymethyl)-4-(4-hydroxyphenyl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 6-(hydroxymethyl)-4-(4-hydroxyphenyl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Openeye Name: 6-(hydroxymethyl)-4-(4-hydroxyphenyl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one CAS Name: 6-(hydroxymethyl)-4-(4-hydroxyphenyl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one IUPAC Name: 6-(hydroxymethyl)-4-(4-hydroxyphenyl)-9-(1H-pyrazol-4-yl)-2H-benzo[h]isoquinolin-1-one Traditional Name: 4-(4-hydroxyphenyl)-6-methylol-9-(1H-pyrazol-4-yl)-2H-benz[h]isoquinolin-1-one Formula: C23H17N3O3 MolecularWeight: 383.39938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CNC(=O)C3=C4C=C(C=CC4=C(C=C23)CO)C5=CNN=C5)O

Isomeric SMILES

C1=CC(=CC=C1C2=CNC(=O)C3=C4C=C(C=CC4=C(C=C23)CO)C5=CNN=C5)O

InChI

InChI=1S/C23H17N3O3/c27-12-15-8-20-21(13-1-4-17(28)5-2-13)11-24-23(29)22(20)19-7-14(3-6-18(15)19)16-9-25-26-10-16/h1-11,27-28H,12H2,(H,24,29)(H,25,26)