N2'-methyl-N2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanediimidamide trihydrochloride

Systemtic Name: N2'-methyl-N2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanediimidamide trihydrochloride Openeye Name: N2'-methyl-N2-[3-[3-(1-piperidylmethyl)phenoxy]propyl]oxalamidine trihydrochloride CAS Name: N2'-methyl-N2-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]ethanediimidamide trihydrochloride IUPAC Name: 2-N'-methyl-2-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanediimidamide trihydrochloride Traditional Name: N2'-methyl-N2-[3-[3-(piperidinomethyl)phenoxy]propyl]oxalamidine trihydrochloride Formula: C18H32Cl3N5O MolecularWeight: 440.83858

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C(=N)N)NCCCOC1=CC=CC(=C1)CN2CCCCC2.Cl.Cl.Cl

Isomeric SMILES

CN=C(C(=N)N)NCCCOC1=CC=CC(=C1)CN2CCCCC2.Cl.Cl.Cl

InChI

InChI=1S/C18H29N5O.3ClH/c1-21-18(17(19)20)22-9-6-12-24-16-8-5-7-15(13-16)14-23-10-3-2-4-11-23;;;/h5,7-8,13H,2-4,6,9-12,14H2,1H3,(H3,19,20)(H,21,22);3*1H