2-[3-[3-(6-chloranylpyridazin-3-yl)oxypropyl-methyl-amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 2-[3-[3-(6-chloranylpyridazin-3-yl)oxypropyl-methyl-amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-[3-[3-(6-chloropyridazin-3-yl)oxypropyl-methyl-amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-[3-[3-[(6-chloro-3-pyridazinyl)oxy]propyl-methylamino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 2-[3-[3-(6-chloropyridazin-3-yl)oxypropyl-methylamino]-2-hydroxypropoxy]benzonitrile Traditional Name: 2-[3-[3-(6-chloropyridazin-3-yl)oxypropyl-methyl-amino]-2-hydroxy-propoxy]benzonitrile Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=NN=C(C=C1)Cl)CC(COC2=CC=CC=C2C#N)O

Isomeric SMILES

CN(CCCOC1=NN=C(C=C1)Cl)CC(COC2=CC=CC=C2C#N)O

InChI

InChI=1S/C18H21ClN4O3/c1-23(9-4-10-25-18-8-7-17(19)21-22-18)12-15(24)13-26-16-6-3-2-5-14(16)11-20/h2-3,5-8,15,24H,4,9-10,12-13H2,1H3