2-[3,4-dimethoxy-2-(2-oxidanyl-3-piperidin-1-yl-propyl)phenyl]-N'-oxidanyl-ethanimidamide dihydrochloride

Systemtic Name: 2-[3,4-dimethoxy-2-(2-oxidanyl-3-piperidin-1-yl-propyl)phenyl]-N'-oxidanyl-ethanimidamide dihydrochloride Openeye Name: N'-hydroxy-2-[2-[2-hydroxy-3-(1-piperidyl)propyl]-3,4-dimethoxy-phenyl]acetamidine dihydrochloride CAS Name: N'-hydroxy-2-[2-[2-hydroxy-3-(1-piperidinyl)propyl]-3,4-dimethoxyphenyl]ethanimidamide dihydrochloride IUPAC Name: N'-hydroxy-2-[2-(2-hydroxy-3-piperidin-1-ylpropyl)-3,4-dimethoxyphenyl]ethanimidamide dihydrochloride Traditional Name: N'-hydroxy-2-[2-(2-hydroxy-3-piperidino-propyl)-3,4-dimethoxy-phenyl]acetamidine dihydrochloride Formula: C18H31Cl2N3O4 MolecularWeight: 424.36244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=NO)N)CC(CN2CCCCC2)O)OC.Cl.Cl

Isomeric SMILES

COC1=C(C(=C(C=C1)C/C(=N/O)/N)CC(CN2CCCCC2)O)OC.Cl.Cl

InChI

InChI=1S/C18H29N3O4.2ClH/c1-24-16-7-6-13(10-17(19)20-23)15(18(16)25-2)11-14(22)12-21-8-4-3-5-9-21;;/h6-7,14,22-23H,3-5,8-12H2,1-2H3,(H2,19,20);2*1H