1-(tert-butylamino)-3-[2-(6-diazanylpyridazin-3-yl)-5-prop-2-enoxy-phenoxy]propan-2-ol

Systemtic Name: 1-(tert-butylamino)-3-[2-(6-diazanylpyridazin-3-yl)-5-prop-2-enoxy-phenoxy]propan-2-ol Openeye Name: 1-[5-allyloxy-2-(6-hydrazinopyridazin-3-yl)phenoxy]-3-(tert-butylamino)propan-2-ol CAS Name: 1-(tert-butylamino)-3-[2-(6-hydrazinyl-3-pyridazinyl)-5-prop-2-enoxyphenoxy]-2-propanol IUPAC Name: 1-(tert-butylamino)-3-[2-(6-hydrazinylpyridazin-3-yl)-5-prop-2-enoxyphenoxy]propan-2-ol Traditional Name: 1-[5-allyloxy-2-(6-hydrazinopyridazin-3-yl)phenoxy]-3-(tert-butylamino)propan-2-ol Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=CC(=C1)OCC=C)C2=NN=C(C=C2)NN)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=CC(=C1)OCC=C)C2=NN=C(C=C2)NN)O

InChI

InChI=1S/C20H29N5O3/c1-5-10-27-15-6-7-16(17-8-9-19(23-21)25-24-17)18(11-15)28-13-14(26)12-22-20(2,3)4/h5-9,11,14,22,26H,1,10,12-13,21H2,2-4H3,(H,23,25)