4-chloranyl-2-[3-(3-oxidanylpropylamino)-1-phenyl-propoxy]benzenecarbonitrile hydrochloride

Systemtic Name: 4-chloranyl-2-[3-(3-oxidanylpropylamino)-1-phenyl-propoxy]benzenecarbonitrile hydrochloride Openeye Name: 4-chloro-2-[3-(3-hydroxypropylamino)-1-phenyl-propoxy]benzonitrile hydrochloride CAS Name: 4-chloro-2-[3-(3-hydroxypropylamino)-1-phenylpropoxy]benzonitrile hydrochloride IUPAC Name: 4-chloro-2-[3-(3-hydroxypropylamino)-1-phenylpropoxy]benzonitrile hydrochloride Traditional Name: 4-chloro-2-[3-(3-hydroxypropylamino)-1-phenyl-propoxy]benzonitrile hydrochloride Formula: C19H22Cl2N2O2 MolecularWeight: 381.29618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNCCCO)OC2=C(C=CC(=C2)Cl)C#N.Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CCNCCCO)OC2=C(C=CC(=C2)Cl)C#N.Cl

InChI

InChI=1S/C19H21ClN2O2.ClH/c20-17-8-7-16(14-21)19(13-17)24-18(9-11-22-10-4-12-23)15-5-2-1-3-6-15;/h1-3,5-8,13,18,22-23H,4,9-12H2;1H