4-chloranyl-5-fluoranyl-2-[3-(2-hydroxyethylamino)-1-phenyl-propoxy]benzenecarbonitrile hydrochloride

Systemtic Name: 4-chloranyl-5-fluoranyl-2-[3-(2-hydroxyethylamino)-1-phenyl-propoxy]benzenecarbonitrile hydrochloride Openeye Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-phenyl-propoxy]benzonitrile hydrochloride CAS Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-phenylpropoxy]benzonitrile hydrochloride IUPAC Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-phenylpropoxy]benzonitrile hydrochloride Traditional Name: 4-chloro-5-fluoro-2-[3-(2-hydroxyethylamino)-1-phenyl-propoxy]benzonitrile hydrochloride Formula: C18H19Cl2FN2O2 MolecularWeight: 385.260063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNCCO)OC2=CC(=C(C=C2C#N)F)Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CCNCCO)OC2=CC(=C(C=C2C#N)F)Cl.Cl

InChI

InChI=1S/C18H18ClFN2O2.ClH/c19-15-11-18(14(12-21)10-16(15)20)24-17(6-7-22-8-9-23)13-4-2-1-3-5-13;/h1-5,10-11,17,22-23H,6-9H2;1H