1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one CAS Name: 1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-(1H-benzimidazol-2-yl)-6-(3,4-dimethoxyphenyl)-6,7-dihydro-5H-indazol-4-one Formula: C22H20N4O3 MolecularWeight: 388.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC3=C(C=NN3C4=NC5=CC=CC=C5N4)C(=O)C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC3=C(C=NN3C4=NC5=CC=CC=C5N4)C(=O)C2)OC

InChI

InChI=1S/C22H20N4O3/c1-28-20-8-7-13(11-21(20)29-2)14-9-18-15(19(27)10-14)12-23-26(18)22-24-16-5-3-4-6-17(16)25-22/h3-8,11-12,14H,9-10H2,1-2H3,(H,24,25)