3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-chloranyl-phenyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-5-chloranyl-phenyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-chloro-phenyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-chlorophenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-chlorophenyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-5-chloro-phenyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)Cl)C2=NNC(=O)CC2)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)Cl)C2=NNC(=O)CC2)O

InChI

InChI=1S/C17H24ClN3O3/c1-17(2,3)19-9-12(22)10-24-15-6-4-11(18)8-13(15)14-5-7-16(23)21-20-14/h4,6,8,12,19,22H,5,7,9-10H2,1-3H3,(H,21,23)