3-[2-(2-methoxy-4-prop-2-ynoxy-phenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[2-(2-methoxy-4-prop-2-ynoxy-phenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[2-(2-methoxy-4-prop-2-ynoxy-phenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[2-(2-methoxy-4-prop-2-ynoxyphenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[2-(2-methoxy-4-prop-2-ynoxyphenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[2-(2-methoxy-4-propargyloxy-phenyl)-1H-indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC#C)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4

Isomeric SMILES

COC1=C(C=CC(=C1)OCC#C)C2=CC3=C(N2)C=CC(=C3)C4=NNC(=O)CC4

InChI

InChI=1S/C22H19N3O3/c1-3-10-28-16-5-6-17(21(13-16)27-2)20-12-15-11-14(4-7-18(15)23-20)19-8-9-22(26)25-24-19/h1,4-7,11-13,23H,8-10H2,2H3,(H,25,26)