4-(4-chloranylphenoxy)-1-[2-([1,2,3]triazolo[4,5-b]pyridin-3-yloxymethyl)morpholin-4-yl]butan-1-one

Systemtic Name: 4-(4-chloranylphenoxy)-1-[2-([1,2,3]triazolo[4,5-b]pyridin-3-yloxymethyl)morpholin-4-yl]butan-1-one Openeye Name: 4-(4-chlorophenoxy)-1-[2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholin-4-yl]butan-1-one CAS Name: 4-(4-chlorophenoxy)-1-[2-(3-triazolo[4,5-b]pyridinyloxymethyl)-4-morpholinyl]-1-butanone IUPAC Name: 4-(4-chlorophenoxy)-1-[2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholin-4-yl]butan-1-one Traditional Name: 4-(4-chlorophenoxy)-1-[2-(triazolo[4,5-b]pyridin-3-yloxymethyl)morpholino]butan-1-one Formula: C20H22ClN5O4 MolecularWeight: 431.87278

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)CCCOC2=CC=C(C=C2)Cl)CON3C4=C(C=CC=N4)N=N3

Isomeric SMILES

C1COC(CN1C(=O)CCCOC2=CC=C(C=C2)Cl)CON3C4=C(C=CC=N4)N=N3

InChI

InChI=1S/C20H22ClN5O4/c21-15-5-7-16(8-6-15)28-11-2-4-19(27)25-10-12-29-17(13-25)14-30-26-20-18(23-24-26)3-1-9-22-20/h1,3,5-9,17H,2,4,10-14H2