3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-(hydroxymethyl)-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-(hydroxymethyl)-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-(hydroxymethyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-(hydroxymethyl)-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-(hydroxymethyl)-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[2-(2,4-dimethoxyphenyl)-1H-indol-5-yl]-4-methylol-4,5-dihydro-1H-pyridazin-6-one Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4CO)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4CO)OC

InChI

InChI=1S/C21H21N3O4/c1-27-15-4-5-16(19(10-15)28-2)18-8-13-7-12(3-6-17(13)22-18)21-14(11-25)9-20(26)23-24-21/h3-8,10,14,22,25H,9,11H2,1-2H3,(H,23,26)