5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(dipropylamino)benzenecarbonitrile hydrochloride

Systemtic Name: 5-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(dipropylamino)benzenecarbonitrile hydrochloride Openeye Name: 5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(dipropylamino)benzonitrile hydrochloride CAS Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]-2-(dipropylamino)benzonitrile hydrochloride IUPAC Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]-2-(dipropylamino)benzonitrile hydrochloride Traditional Name: 5-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(dipropylamino)benzonitrile hydrochloride Formula: C19H32ClN3O MolecularWeight: 353.92988

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C=C1)C(CNC(C)(C)C)O)C#N.Cl

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C=C1)C(CNC(C)(C)C)O)C#N.Cl

InChI

InChI=1S/C19H31N3O.ClH/c1-6-10-22(11-7-2)17-9-8-15(12-16(17)13-20)18(23)14-21-19(3,4)5;/h8-9,12,18,21,23H,6-7,10-11,14H2,1-5H3;1H