2-chloranyl-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(pyrrolidin-2-ylmethoxy)pyridine dihydrochloride

Systemtic Name: 2-chloranyl-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(pyrrolidin-2-ylmethoxy)pyridine dihydrochloride Openeye Name: 2-chloro-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(pyrrolidin-2-ylmethoxy)pyridine dihydrochloride CAS Name: 2-chloro-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(2-pyrrolidinylmethoxy)pyridine dihydrochloride IUPAC Name: 2-chloro-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(pyrrolidin-2-ylmethoxy)pyridine dihydrochloride Traditional Name: 2-chloro-3-[(1E,3E)-5,5-dimethylhexa-1,3-dienyl]-5-(pyrrolidin-2-ylmethoxy)pyridine dihydrochloride Formula: C18H27Cl3N2O MolecularWeight: 393.77878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=CC=CC1=CC(=CN=C1Cl)OCC2CCCN2.Cl.Cl

Isomeric SMILES

CC(C)(C)/C=C/C=C/C1=CC(=CN=C1Cl)OCC2CCCN2.Cl.Cl

InChI

InChI=1S/C18H25ClN2O.2ClH/c1-18(2,3)9-5-4-7-14-11-16(12-21-17(14)19)22-13-15-8-6-10-20-15;;/h4-5,7,9,11-12,15,20H,6,8,10,13H2,1-3H3;2*1H/b7-4+,9-5+;;