6-(3,3-dimethyl-1-propan-2-yl-2H-indol-5-yl)-5-(hydroxymethyl)-2-octyl-4,5-dihydropyridazin-3-one

Systemtic Name: 6-(3,3-dimethyl-1-propan-2-yl-2H-indol-5-yl)-5-(hydroxymethyl)-2-octyl-4,5-dihydropyridazin-3-one Openeye Name: 5-(hydroxymethyl)-6-(1-isopropyl-3,3-dimethyl-indolin-5-yl)-2-octyl-4,5-dihydropyridazin-3-one CAS Name: 6-(3,3-dimethyl-1-propan-2-yl-2H-indol-5-yl)-5-(hydroxymethyl)-2-octyl-4,5-dihydropyridazin-3-one IUPAC Name: 6-(3,3-dimethyl-1-propan-2-yl-2H-indol-5-yl)-5-(hydroxymethyl)-2-octyl-4,5-dihydropyridazin-3-one Traditional Name: 6-(1-isopropyl-3,3-dimethyl-indolin-5-yl)-5-methylol-2-octyl-4,5-dihydropyridazin-3-one Formula: C26H41N3O2 MolecularWeight: 427.62264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)CC(C(=N1)C2=CC3=C(C=C2)N(CC3(C)C)C(C)C)CO

Isomeric SMILES

CCCCCCCCN1C(=O)CC(C(=N1)C2=CC3=C(C=C2)N(CC3(C)C)C(C)C)CO

InChI

InChI=1S/C26H41N3O2/c1-6-7-8-9-10-11-14-29-24(31)16-21(17-30)25(27-29)20-12-13-23-22(15-20)26(4,5)18-28(23)19(2)3/h12-13,15,19,21,30H,6-11,14,16-18H2,1-5H3